USER MOD reduce.3.24.130724 H: found=0, std=0, add=2252, rem=0, adj=70 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER TRANSFERASE/INHIBITOR 15-JUN-15 5C26 TITLE CRYSTAL STRUCTURE OF SYK IN COMPLEX WITH COMPOUND 1 COMPND MOL_ID: 1; COMPND 2 MOLECULE: TYROSINE-PROTEIN KINASE SYK; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: UNP RESIDUES 343-635; COMPND 5 SYNONYM: SPLEEN TYROSINE KINASE,P72-SYK; COMPND 6 EC: 2.7.10.2; COMPND 7 ENGINEERED: YES; COMPND 8 MOL_ID: 2; COMPND 9 MOLECULE: GLU-VAL-PTR-GLU-SER-PRO; COMPND 0 CHAIN: B; COMPND 1 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: SYK; SOURCE 6 EXPRESSION_SYSTEM: SPODOPTERA FRUGIPERDA; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 7108; SOURCE 8 MOL_ID: 2; SOURCE 9 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 0 ORGANISM_COMMON: HUMAN; SOURCE 1 ORGANISM_TAXID: 9606; SOURCE 2 EXPRESSION_SYSTEM: SPODOPTERA FRUGIPERDA; SOURCE 3 EXPRESSION_SYSTEM_TAXID: 7108 KEYWDS SPLEEN TYROSINE KINASE, INHIBITOR, TRANSFERASE-INHIBITOR COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR S.HAN,J.CHANG REVDAT 2 03-FEB-16 5C26 1 JRNL REVDAT 1 07-OCT-15 5C26 0 JRNL AUTH F.LOVERING,C.AEVAZELIS,J.CHANG,C.DEHNHARDT,L.FITZ,S.HAN, JRNL AUTH 2 K.JANZ,J.LEE,N.KAILA,J.MCDONALD,W.MOORE,A.MORETTO, JRNL AUTH 3 N.PAPAIOANNOU,D.RICHARD,M.S.RYAN,Z.K.WAN,A.THORARENSEN JRNL TITL IMIDAZOTRIAZINES: SPLEEN TYROSINE KINASE (SYK) INHIBITORS JRNL TITL 2 IDENTIFIED BY FREE-ENERGY PERTURBATION (FEP). JRNL REF CHEMMEDCHEM V. 11 217 2016 JRNL REFN ESSN 1860-7187 JRNL PMID 26381330 JRNL DOI 10.1002/CMDC.201500333 REMARK 2 REMARK 2 RESOLUTION. 1.95 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : BUSTER 2.9.5 REMARK 3 AUTHORS : BRICOGNE,BLANC,BRANDL,FLENSBURG,KELLER, REMARK 3 : PACIOREK,ROVERSI,SHARFF,SMART,VONRHEIN, REMARK 3 : WOMACK,MATTHEWS,TEN EYCK,TRONRUD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.95 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 44.98 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.5 REMARK 3 NUMBER OF REFLECTIONS : 23153 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.186 REMARK 3 R VALUE (WORKING SET) : 0.185 REMARK 3 FREE R VALUE : 0.215 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.130 REMARK 3 FREE R VALUE TEST SET COUNT : 1187 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 12 REMARK 3 BIN RESOLUTION RANGE HIGH (ANGSTROMS) : 1.95 REMARK 3 BIN RESOLUTION RANGE LOW (ANGSTROMS) : 2.04 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 99.46 REMARK 3 REFLECTIONS IN BIN (WORKING + TEST SET) : 2681 REMARK 3 BIN R VALUE (WORKING + TEST SET) : 0.2121 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 2556 REMARK 3 BIN R VALUE (WORKING SET) : 0.2088 REMARK 3 BIN FREE R VALUE : 0.2833 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 4.66 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 125 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2292 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 29 REMARK 3 SOLVENT ATOMS : 183 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 31.58 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 37.63 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 6.61870 REMARK 3 B22 (A**2) : 5.88060 REMARK 3 B33 (A**2) : -12.49930 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.209 REMARK 3 DPI (BLOW EQ-10) BASED ON R VALUE (A) : 0.167 REMARK 3 DPI (BLOW EQ-9) BASED ON FREE R VALUE (A) : 0.141 REMARK 3 DPI (CRUICKSHANK) BASED ON R VALUE (A) : 0.157 REMARK 3 DPI (CRUICKSHANK) BASED ON FREE R VALUE (A) : 0.137 REMARK 3 REMARK 3 REFERENCES: BLOW, D. (2002) ACTA CRYST D58, 792-797 REMARK 3 CRUICKSHANK, D.W.J. (1999) ACTA CRYST D55, 583-601 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.933 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.907 REMARK 3 REMARK 3 NUMBER OF GEOMETRIC FUNCTION TERMS DEFINED : 15 REMARK 3 TERM COUNT WEIGHT FUNCTION. REMARK 3 BOND LENGTHS : 2378 ; 2.000 ; HARMONIC REMARK 3 BOND ANGLES : 3216 ; 2.000 ; HARMONIC REMARK 3 TORSION ANGLES : 825 ; 2.000 ; SINUSOIDAL REMARK 3 TRIGONAL CARBON PLANES : 63 ; 2.000 ; HARMONIC REMARK 3 GENERAL PLANES : 343 ; 5.000 ; HARMONIC REMARK 3 ISOTROPIC THERMAL FACTORS : 2378 ; 20.000 ; HARMONIC REMARK 3 BAD NON-BONDED CONTACTS : 0 ; 5.000 ; SEMIHARMONIC REMARK 3 IMPROPER TORSIONS : NULL ; NULL ; NULL REMARK 3 PSEUDOROTATION ANGLES : NULL ; NULL ; NULL REMARK 3 CHIRAL IMPROPER TORSION : 275 ; 5.000 ; SEMIHARMONIC REMARK 3 SUM OF OCCUPANCIES : NULL ; NULL ; NULL REMARK 3 UTILITY DISTANCES : NULL ; NULL ; NULL REMARK 3 UTILITY ANGLES : NULL ; NULL ; NULL REMARK 3 UTILITY TORSION : NULL ; NULL ; NULL REMARK 3 IDEAL-DIST CONTACT TERM : 2652 ; 4.000 ; SEMIHARMONIC REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.010 REMARK 3 BOND ANGLES (DEGREES) : 1.04 REMARK 3 PEPTIDE OMEGA TORSION ANGLES (DEGREES) : 3.01 REMARK 3 OTHER TORSION ANGLES (DEGREES) : 17.26 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 5C26 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 07-JUL-15. REMARK 100 THE DEPOSITION ID IS D_1000210906. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 11-JUN-14 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 5.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 17-ID REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.0 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : PIXEL REMARK 200 DETECTOR MANUFACTURER : DECTRIS PILATUS 6M REMARK 200 INTENSITY-INTEGRATION SOFTWARE : NULL REMARK 200 DATA SCALING SOFTWARE : AIMLESS, SCALA REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 23209 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.950 REMARK 200 RESOLUTION RANGE LOW (A) : 90.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 98.3 REMARK 200 DATA REDUNDANCY : 6.400 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 16.2000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL REMARK 200 COMPLETENESS FOR SHELL (%) : NULL REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: FOURIER SYNTHESIS REMARK 200 SOFTWARE USED: BUSTER REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 42.55 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.14 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 1.75 M AMMONIUM SULFATE, 0.1 M SODIUM REMARK 280 CITRATE, 0.1 M SODIUM ACETATE PH 5.5, VAPOR DIFFUSION, REMARK 280 TEMPERATURE 295K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X+1/2,-Y,Z+1/2 REMARK 290 3555 -X,Y+1/2,-Z+1/2 REMARK 290 4555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 19.99500 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 44.98000 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 42.86000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 44.98000 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 19.99500 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 42.86000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 820 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 14140 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -6.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET A 343 REMARK 465 ASP A 344 REMARK 465 THR A 345 REMARK 465 GLU A 346 REMARK 465 VAL A 347 REMARK 465 TYR A 348 REMARK 465 GLU A 349 REMARK 465 SER A 350 REMARK 465 PRO A 351 REMARK 465 TYR A 352 REMARK 465 ALA A 353 REMARK 465 ASP A 354 REMARK 465 PRO A 355 REMARK 465 GLU A 356 REMARK 465 GLU A 357 REMARK 465 ILE A 358 REMARK 465 ARG A 359 REMARK 465 PRO A 360 REMARK 465 LYS A 361 REMARK 465 GLU A 362 REMARK 465 HIS A 637 REMARK 465 HIS A 638 REMARK 465 HIS A 639 REMARK 465 HIS A 640 REMARK 465 HIS A 641 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 LYS A 394 -52.70 -142.52 REMARK 500 ALA A 441 -119.89 -142.33 REMARK 500 ASP A 494 42.90 -150.88 REMARK 500 ASP A 512 80.73 59.93 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue 50H A 701 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 5C27 RELATED DB: PDB DBREF 5C26 A 343 635 UNP P43405 KSYK_HUMAN 343 635 DBREF 5C26 B 346 351 PDB 5C26 5C26 346 351 SEQADV 5C26 HIS A 636 UNP P43405 EXPRESSION TAG SEQADV 5C26 HIS A 637 UNP P43405 EXPRESSION TAG SEQADV 5C26 HIS A 638 UNP P43405 EXPRESSION TAG SEQADV 5C26 HIS A 639 UNP P43405 EXPRESSION TAG SEQADV 5C26 HIS A 640 UNP P43405 EXPRESSION TAG SEQADV 5C26 HIS A 641 UNP P43405 EXPRESSION TAG SEQRES 1 A 299 MET ASP THR GLU VAL TYR GLU SER PRO TYR ALA ASP PRO SEQRES 2 A 299 GLU GLU ILE ARG PRO LYS GLU VAL TYR LEU ASP ARG LYS SEQRES 3 A 299 LEU LEU THR LEU GLU ASP LYS GLU LEU GLY SER GLY ASN SEQRES 4 A 299 PHE GLY THR VAL LYS LYS GLY TYR TYR GLN MET LYS LYS SEQRES 5 A 299 VAL VAL LYS THR VAL ALA VAL LYS ILE LEU LYS ASN GLU SEQRES 6 A 299 ALA ASN ASP PRO ALA LEU LYS ASP GLU LEU LEU ALA GLU SEQRES 7 A 299 ALA ASN VAL MET GLN GLN LEU ASP ASN PRO TYR ILE VAL SEQRES 8 A 299 ARG MET ILE GLY ILE CYS GLU ALA GLU SER TRP MET LEU SEQRES 9 A 299 VAL MET GLU MET ALA GLU LEU GLY PRO LEU ASN LYS TYR SEQRES 10 A 299 LEU GLN GLN ASN ARG HIS VAL LYS ASP LYS ASN ILE ILE SEQRES 11 A 299 GLU LEU VAL HIS GLN VAL SER MET GLY MET LYS TYR LEU SEQRES 12 A 299 GLU GLU SER ASN PHE VAL HIS ARG ASP LEU ALA ALA ARG SEQRES 13 A 299 ASN VAL LEU LEU VAL THR GLN HIS TYR ALA LYS ILE SER SEQRES 14 A 299 ASP PHE GLY LEU SER LYS ALA LEU ARG ALA ASP GLU ASN SEQRES 15 A 299 PTR PTR LYS ALA GLN THR HIS GLY LYS TRP PRO VAL LYS SEQRES 16 A 299 TRP TYR ALA PRO GLU CYS ILE ASN TYR TYR LYS PHE SER SEQRES 17 A 299 SER LYS SER ASP VAL TRP SER PHE GLY VAL LEU MET TRP SEQRES 18 A 299 GLU ALA PHE SER TYR GLY GLN LYS PRO TYR ARG GLY MET SEQRES 19 A 299 LYS GLY SER GLU VAL THR ALA MET LEU GLU LYS GLY GLU SEQRES 20 A 299 ARG MET GLY CYS PRO ALA GLY CYS PRO ARG GLU MET TYR SEQRES 21 A 299 ASP LEU MET ASN LEU CYS TRP THR TYR ASP VAL GLU ASN SEQRES 22 A 299 ARG PRO GLY PHE ALA ALA VAL GLU LEU ARG LEU ARG ASN SEQRES 23 A 299 TYR TYR TYR ASP VAL VAL ASN HIS HIS HIS HIS HIS HIS SEQRES 1 B 6 GLU VAL PTR GLU SER PRO MODRES 5C26 PTR A 525 TYR MODIFIED RESIDUE MODRES 5C26 PTR A 526 TYR MODIFIED RESIDUE HET PTR A 525 16 HET PTR A 526 16 HET PTR B 348 16 HET 50H A 701 29 HETNAM PTR O-PHOSPHOTYROSINE HETNAM 50H 3-{8-[(3,4-DIMETHOXYPHENYL)AMINO]IMIDAZO[1,2-A]PYRAZIN- HETNAM 2 50H 6-YL}BENZAMIDE HETSYN PTR PHOSPHONOTYROSINE FORMUL 1 PTR 3(C9 H12 N O6 P) FORMUL 3 50H C21 H19 N5 O3 FORMUL 4 HOH *183(H2 O) HELIX 1 AA1 ASP A 366 LYS A 368 5 3 HELIX 2 AA2 ASP A 410 LEU A 427 1 18 HELIX 3 AA3 LEU A 456 ASN A 463 1 8 HELIX 4 AA4 LYS A 467 SER A 488 1 22 HELIX 5 AA5 ALA A 496 ARG A 498 5 3 HELIX 6 AA6 PRO A 535 TYR A 539 5 5 HELIX 7 AA7 ALA A 540 TYR A 547 1 8 HELIX 8 AA8 SER A 550 SER A 567 1 18 HELIX 9 AA9 LYS A 577 LYS A 587 1 11 HELIX 10 AB1 PRO A 598 TRP A 609 1 12 HELIX 11 AB2 GLY A 618 HIS A 636 1 19 SHEET 1 AA1 5 LEU A 370 SER A 379 0 SHEET 2 AA1 5 GLY A 383 GLN A 391 -1 O TYR A 389 N THR A 371 SHEET 3 AA1 5 VAL A 396 LEU A 404 -1 O ILE A 403 N THR A 384 SHEET 4 AA1 5 TRP A 444 GLU A 449 -1 O MET A 448 N ALA A 400 SHEET 5 AA1 5 MET A 435 GLU A 440 -1 N ILE A 436 O VAL A 447 SHEET 1 AA2 3 GLY A 454 PRO A 455 0 SHEET 2 AA2 3 VAL A 500 THR A 504 -1 O LEU A 502 N GLY A 454 SHEET 3 AA2 3 TYR A 507 ILE A 510 -1 O TYR A 507 N VAL A 503 SHEET 1 AA3 2 PHE A 490 VAL A 491 0 SHEET 2 AA3 2 LYS A 517 ALA A 518 -1 O LYS A 517 N VAL A 491 SHEET 1 AA4 2 PTR A 526 LYS A 527 0 SHEET 2 AA4 2 LYS A 548 PHE A 549 -1 O PHE A 549 N PTR A 526 LINK C ASN A 524 N PTR A 525 1555 1555 1.33 LINK C PTR A 525 N PTR A 526 1555 1555 1.33 LINK C PTR A 526 N LYS A 527 1555 1555 1.34 LINK C VAL B 347 N PTR B 348 1555 1555 1.34 LINK C PTR B 348 N GLU B 349 1555 1555 1.34 SITE *** AC1 11 PHE A 382 VAL A 385 ALA A 400 GLU A 449 SITE *** AC1 11 MET A 450 ALA A 451 GLU A 452 GLY A 454 SITE *** AC1 11 PRO A 455 LYS A 458 LEU A 501 CRYST1 39.990 85.720 89.960 90.00 90.00 90.00 P 21 21 21 4 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.025006 0.000000 0.000000 0.00000 SCALE2 0.000000 0.011666 0.000000 0.00000 SCALE3 0.000000 0.000000 0.011116 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 525 PTR HN2 : A 525 PTR N : A 524 ASN C :(H bumps) USER MOD NoAdj-H: A 526 PTR HN2 : A 526 PTR N : A 525 PTR C :(H bumps) USER MOD NoAdj-H: A 526 PTR H : A 526 PTR N : A 525 PTR C :(H bumps) USER MOD NoAdj-H: B 348 PTR HN2 : B 348 PTR N : B 347 VAL C :(H bumps) USER MOD NoAdj-H: B 348 PTR H : B 348 PTR N : B 347 VAL C :(H bumps) USER MOD Set 1.1: A 597 CYS SG : rot 93:sc= 0.116 USER MOD Set 1.2: A 605 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 550 SER OG : rot -91:sc= 0.867 USER MOD Set 2.2: A 553 SER OG : rot -45:sc= 1.88 USER MOD Set 3.1: A 470 ASN : amide:sc= 1.46 K(o=2.1,f=-1.1) USER MOD Set 3.2: A 505 GLN : amide:sc= 0.664 K(o=2.1,f=0.83) USER MOD Set 4.1: A 439 CYS SG : rot 180:sc= 0 USER MOD Set 4.2: A 445 MET CE :methyl -124:sc= -0.552 (180deg=-3.42!) USER MOD Set 5.1: A 431 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 476 HIS : no HD1:sc= 1.96 K(o=1.8,f=-6.1!) USER MOD Set 5.3: A 480 MET CE :methyl -168:sc= -0.144 (180deg=-0.35) USER MOD Single : A 364 TYR OH : rot 180:sc= 0 USER MOD Single : A 368 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 371 THR OG1 : rot 180:sc= 0 USER MOD Single : A 375 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 379 SER OG : rot 180:sc= 0 USER MOD Single : A 381 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 384 THR OG1 : rot 180:sc= 0 USER MOD Single : A 386 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 387 LYS NZ :NH3+ -166:sc= 1.34 (180deg=1.29) USER MOD Single : A 389 TYR OH : rot -66:sc= 0.538 USER MOD Single : A 390 TYR OH : rot 180:sc= 0.149 USER MOD Single : A 391 GLN : amide:sc= 2.12 K(o=2.1,f=-0.096) USER MOD Single : A 392 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 393 LYS NZ :NH3+ 174:sc=-0.00229 (180deg=-0.0214) USER MOD Single : A 394 LYS NZ :NH3+ 161:sc= 1.27 (180deg=1.22) USER MOD Single : A 397 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.159) USER MOD Single : A 398 THR OG1 : rot 180:sc= 0 USER MOD Single : A 402 LYS NZ :NH3+ -177:sc= 0.882 (180deg=0.877) USER MOD Single : A 405 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.315) USER MOD Single : A 406 ASN : amide:sc=-0.00536 X(o=-0.0054,f=0) USER MOD Single : A 409 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 414 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 422 ASN : amide:sc=-0.00306 X(o=-0.0031,f=0) USER MOD Single : A 424 MET CE :methyl -116:sc= -0.055 (180deg=-0.24) USER MOD Single : A 425 GLN : amide:sc= -0.0313 X(o=-0.031,f=0) USER MOD Single : A 426 GLN : amide:sc= 0.879 K(o=0.88,f=-0.0028) USER MOD Single : A 429 ASN : amide:sc= 0.399 K(o=0.4,f=-1.8!) USER MOD Single : A 435 MET CE :methyl 163:sc= -0.0339 (180deg=-0.303) USER MOD Single : A 443 SER OG : rot 170:sc= 1.31 USER MOD Single : A 448 MET CE :methyl -165:sc=-0.00753 (180deg=-0.152) USER MOD Single : A 450 MET CE :methyl -122:sc= -0.752 (180deg=-3.87!) USER MOD Single : A 457 ASN : amide:sc= 0.442 K(o=0.44,f=-2.5) USER MOD Single : A 458 LYS NZ :NH3+ -112:sc= 0.883 (180deg=0.181) USER MOD Single : A 459 TYR OH : rot 30:sc= -0.0193 USER MOD Single : A 461 GLN : amide:sc= 0.0765 X(o=0.076,f=-0.41) USER MOD Single : A 462 GLN : amide:sc=-0.00275 X(o=-0.0028,f=-0.0028) USER MOD Single : A 463 ASN : amide:sc= 0.755 K(o=0.75,f=0) USER MOD Single : A 465 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 467 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 469 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 477 GLN : amide:sc= 1.22 K(o=1.2,f=-5!) USER MOD Single : A 479 SER OG : rot -45:sc= 1.3 USER MOD Single : A 482 MET CE :methyl -162:sc= -0.0837 (180deg=-0.449) USER MOD Single : A 483 LYS NZ :NH3+ 162:sc= 0.597 (180deg=0.439) USER MOD Single : A 484 TYR OH : rot 30:sc= 0.503 USER MOD Single : A 488 SER OG : rot 76:sc= 0.62 USER MOD Single : A 489 ASN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 492 HIS : no HD1:sc= 0.496 K(o=0.5,f=-5.6!) USER MOD Single : A 499 ASN : amide:sc= 1.34 K(o=1.3,f=-1) USER MOD Single : A 504 THR OG1 : rot 180:sc= 0.102 USER MOD Single : A 506 HIS : no HE2:sc= 2.41 K(o=2.4,f=-7.8!) USER MOD Single : A 507 TYR OH : rot -14:sc= 1.3 USER MOD Single : A 509 LYS NZ :NH3+ 169:sc= 0.458 (180deg=0.404) USER MOD Single : A 511 SER OG : rot -43:sc= 1.31 USER MOD Single : A 516 SER OG : rot -23:sc= 0.968 USER MOD Single : A 517 LYS NZ :NH3+ 162:sc= 1.14 (180deg=0.924) USER MOD Single : A 524 ASN :FLIP amide:sc= 0.098 F(o=-0.63,f=0.098) USER MOD Single : A 527 LYS NZ :NH3+ -116:sc= 1.02 (180deg=-0.313) USER MOD Single : A 529 GLN : amide:sc=-0.000408 K(o=-0.00041,f=-1.1) USER MOD Single : A 530 THR OG1 : rot 180:sc= 0 USER MOD Single : A 531 HIS : no HE2:sc= -0.385 K(o=-0.38,f=-3.1) USER MOD Single : A 533 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 537 LYS NZ :NH3+ 165:sc= 1.95 (180deg=1.89) USER MOD Single : A 539 TYR OH : rot 14:sc= 1.31 USER MOD Single : A 543 CYS SG : rot -108:sc= 0.0112 USER MOD Single : A 545 ASN : amide:sc= 0.0364 X(o=0.036,f=-0.098) USER MOD Single : A 546 TYR OH : rot 180:sc= 1.18 USER MOD Single : A 547 TYR OH : rot 180:sc= 0 USER MOD Single : A 548 LYS NZ :NH3+ 162:sc= 0.372 (180deg=0.28) USER MOD Single : A 551 SER OG : rot -67:sc= 1.12 USER MOD Single : A 552 LYS NZ :NH3+ -178:sc= 0.777 (180deg=0.776) USER MOD Single : A 557 SER OG : rot -51:sc= 2.57 USER MOD Single : A 562 MET CE :methyl -135:sc=-0.00595 (180deg=-0.359) USER MOD Single : A 567 SER OG : rot 84:sc= 1.89 USER MOD Single : A 568 TYR OH : rot -16:sc= 1.33 USER MOD Single : A 570 GLN : amide:sc= -0.0275 X(o=-0.027,f=0) USER MOD Single : A 571 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 573 TYR OH : rot -37:sc= 2.05 USER MOD Single : A 576 MET CE :methyl 160:sc= 0 (180deg=-0.113) USER MOD Single : A 577 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 579 SER OG : rot 180:sc= 0 USER MOD Single : A 582 THR OG1 : rot 180:sc= 0 USER MOD Single : A 584 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 587 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 591 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 593 CYS SG : rot 180:sc=-0.00841 USER MOD Single : A 601 MET CE :methyl -103:sc= -0.121 (180deg=-2.9!) USER MOD Single : A 602 TYR OH : rot 1:sc= 1.39 USER MOD Single : A 606 ASN : amide:sc= 1.24 K(o=1.2,f=0.69) USER MOD Single : A 608 CYS SG : rot 70:sc= 0.0225 USER MOD Single : A 610 THR OG1 : rot 82:sc= 1.27 USER MOD Single : A 611 TYR OH : rot 180:sc= 1.29 USER MOD Single : A 615 ASN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 628 ASN : amide:sc= -0.0132 K(o=-0.013,f=-0.68) USER MOD Single : A 629 TYR OH : rot 57:sc= 0 USER MOD Single : A 630 TYR OH : rot 180:sc= 0 USER MOD Single : A 631 TYR OH : rot 180:sc= 0 USER MOD Single : A 635 ASN :FLIP amide:sc= 0 F(o=-0.51,f=0) USER MOD Single : A 636 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 350 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 363 -23.048 -1.636 -11.624 1.00 52.74 N ATOM 2 CA VAL A 363 -21.855 -0.934 -11.144 1.00 51.87 C ATOM 3 C VAL A 363 -21.249 -1.601 -9.886 1.00 52.21 C ATOM 4 O VAL A 363 -20.046 -1.480 -9.653 1.00 50.16 O ATOM 5 CB VAL A 363 -22.096 0.596 -10.998 1.00 56.41 C ATOM 6 CG1 VAL A 363 -22.760 0.956 -9.668 1.00 56.40 C ATOM 7 CG2 VAL A 363 -20.808 1.386 -11.198 1.00 56.51 C ATOM 0 HA VAL A 363 -21.173 -1.021 -11.828 1.00 51.87 H new ATOM 0 HB VAL A 363 -22.714 0.847 -11.702 1.00 56.41 H new ATOM 0 HG11 VAL A 363 -22.890 1.916 -9.621 1.00 56.40 H new ATOM 0 HG12 VAL A 363 -23.619 0.510 -9.604 1.00 56.40 H new ATOM 0 HG13 VAL A 363 -22.192 0.671 -8.935 1.00 56.40 H new ATOM 0 HG21 VAL A 363 -20.991 2.334 -11.101 1.00 56.51 H new ATOM 0 HG22 VAL A 363 -20.155 1.114 -10.535 1.00 56.51 H new ATOM 0 HG23 VAL A 363 -20.457 1.214 -12.086 1.00 56.51 H new ATOM 8 N TYR A 364 -22.084 -2.304 -9.082 1.00 47.62 N ATOM 9 CA TYR A 364 -21.612 -2.994 -7.878 1.00 46.62 C ATOM 10 C TYR A 364 -21.222 -4.419 -8.199 1.00 45.92 C ATOM 11 O TYR A 364 -22.008 -5.164 -8.789 1.00 46.23 O ATOM 12 CB TYR A 364 -22.622 -2.903 -6.729 1.00 49.13 C ATOM 13 CG TYR A 364 -22.605 -1.548 -6.054 1.00 52.69 C ATOM 14 CD1 TYR A 364 -21.696 -1.264 -5.038 1.00 54.96 C ATOM 15 CD2 TYR A 364 -23.476 -0.539 -6.453 1.00 54.13 C ATOM 16 CE1 TYR A 364 -21.661 -0.009 -4.430 1.00 57.07 C ATOM 17 CE2 TYR A 364 -23.443 0.723 -5.859 1.00 55.34 C ATOM 18 CZ TYR A 364 -22.535 0.983 -4.847 1.00 63.88 C ATOM 19 OH TYR A 364 -22.509 2.223 -4.258 1.00 66.50 O ATOM 0 H TYR A 364 -22.928 -2.387 -9.227 1.00 47.62 H new ATOM 0 HA TYR A 364 -20.815 -2.539 -7.565 1.00 46.62 H new ATOM 0 HB2 TYR A 364 -23.513 -3.081 -7.069 1.00 49.13 H new ATOM 0 HB3 TYR A 364 -22.426 -3.591 -6.074 1.00 49.13 H new ATOM 0 HD1 TYR A 364 -21.102 -1.923 -4.760 1.00 54.96 H new ATOM 0 HD2 TYR A 364 -24.092 -0.709 -7.129 1.00 54.13 H new ATOM 0 HE1 TYR A 364 -21.053 0.162 -3.747 1.00 57.07 H new ATOM 0 HE2 TYR A 364 -24.029 1.387 -6.142 1.00 55.34 H new ATOM 0 HH TYR A 364 -23.090 2.714 -4.613 1.00 66.50 H new ATOM 20 N LEU A 365 -19.980 -4.776 -7.862 1.00 38.49 N ATOM 21 CA LEU A 365 -19.427 -6.099 -8.145 1.00 36.70 C ATOM 22 C LEU A 365 -19.436 -6.991 -6.927 1.00 40.68 C ATOM 23 O LEU A 365 -19.515 -6.501 -5.796 1.00 40.13 O ATOM 24 CB LEU A 365 -18.005 -5.997 -8.729 1.00 35.39 C ATOM 25 CG LEU A 365 -17.802 -5.077 -9.943 1.00 38.44 C ATOM 26 CD1 LEU A 365 -16.337 -5.011 -10.313 1.00 37.53 C ATOM 27 CD2 LEU A 365 -18.629 -5.531 -11.152 1.00 38.29 C ATOM 0 H LEU A 365 -19.432 -4.250 -7.459 1.00 38.49 H new ATOM 0 HA LEU A 365 -20.004 -6.506 -8.810 1.00 36.70 H new ATOM 0 HB2 LEU A 365 -17.412 -5.696 -8.023 1.00 35.39 H new ATOM 0 HB3 LEU A 365 -17.719 -6.890 -8.979 1.00 35.39 H new ATOM 0 HG LEU A 365 -18.111 -4.193 -9.691 1.00 38.44 H new ATOM 0 HD11 LEU A 365 -16.223 -4.428 -11.080 1.00 37.53 H new ATOM 0 HD12 LEU A 365 -15.829 -4.663 -9.564 1.00 37.53 H new ATOM 0 HD13 LEU A 365 -16.018 -5.900 -10.533 1.00 37.53 H new ATOM 0 HD21 LEU A 365 -18.474 -4.927 -11.895 1.00 38.29 H new ATOM 0 HD22 LEU A 365 -18.366 -6.429 -11.406 1.00 38.29 H new ATOM 0 HD23 LEU A 365 -19.571 -5.524 -10.921 1.00 38.29 H new ATOM 28 N ASP A 366 -19.305 -8.306 -7.168 1.00 36.83 N ATOM 29 CA ASP A 366 -19.314 -9.343 -6.153 1.00 35.70 C ATOM 30 C ASP A 366 -17.889 -9.739 -5.752 1.00 37.72 C ATOM 31 O ASP A 366 -17.167 -10.325 -6.562 1.00 35.94 O ATOM 32 CB ASP A 366 -20.111 -10.538 -6.719 1.00 37.77 C ATOM 33 CG ASP A 366 -20.411 -11.704 -5.792 1.00 46.36 C ATOM 34 OD1 ASP A 366 -19.931 -11.691 -4.638 1.00 46.98 O ATOM 35 OD2 ASP A 366 -21.103 -12.641 -6.232 1.00 51.56 O1- ATOM 0 H ASP A 366 -19.205 -8.619 -7.963 1.00 36.83 H new ATOM 0 HA ASP A 366 -19.738 -9.022 -5.341 1.00 35.70 H new ATOM 0 HB2 ASP A 366 -20.957 -10.199 -7.052 1.00 37.77 H new ATOM 0 HB3 ASP A 366 -19.623 -10.884 -7.483 1.00 37.77 H new ATOM 36 N ARG A 367 -17.491 -9.466 -4.483 1.00 34.79 N ATOM 37 CA ARG A 367 -16.156 -9.831 -3.982 1.00 35.40 C ATOM 38 C ARG A 367 -15.776 -11.312 -4.239 1.00 42.09 C ATOM 39 O ARG A 367 -14.596 -11.603 -4.479 1.00 42.69 O ATOM 40 CB ARG A 367 -15.983 -9.443 -2.495 1.00 34.96 C ATOM 41 CG ARG A 367 -14.560 -9.615 -1.915 1.00 39.63 C ATOM 42 CD ARG A 367 -13.512 -8.737 -2.589 1.00 40.60 C ATOM 43 NE ARG A 367 -12.156 -8.961 -2.073 1.00 43.69 N ATOM 44 CZ ARG A 367 -11.299 -9.843 -2.576 1.00 57.43 C ATOM 45 NH1 ARG A 367 -11.649 -10.610 -3.603 1.00 40.64 N ATOM 46 NH2 ARG A 367 -10.086 -9.971 -2.053 1.00 50.95 N ATOM 0 H ARG A 367 -17.987 -9.069 -3.903 1.00 34.79 H new ATOM 0 HA ARG A 367 -15.526 -9.309 -4.503 1.00 35.40 H new ATOM 0 HB2 ARG A 367 -16.248 -8.516 -2.387 1.00 34.96 H new ATOM 0 HB3 ARG A 367 -16.596 -9.977 -1.966 1.00 34.96 H new ATOM 0 HG2 ARG A 367 -14.579 -9.411 -0.967 1.00 39.63 H new ATOM 0 HG3 ARG A 367 -14.295 -10.544 -2.000 1.00 39.63 H new ATOM 0 HD2 ARG A 367 -13.521 -8.907 -3.544 1.00 40.60 H new ATOM 0 HD3 ARG A 367 -13.750 -7.805 -2.464 1.00 40.60 H new ATOM 0 HE ARG A 367 -11.899 -8.490 -1.401 1.00 43.69 H new ATOM 0 HH11 ARG A 367 -12.434 -10.537 -3.946 1.00 40.64 H new ATOM 0 HH12 ARG A 367 -11.090 -11.179 -3.925 1.00 40.64 H new ATOM 0 HH21 ARG A 367 -9.852 -9.482 -1.386 1.00 50.95 H new ATOM 0 HH22 ARG A 367 -9.534 -10.543 -2.382 1.00 50.95 H new ATOM 47 N LYS A 368 -16.779 -12.230 -4.226 1.00 39.85 N ATOM 48 CA LYS A 368 -16.594 -13.675 -4.474 1.00 39.42 C ATOM 49 C LYS A 368 -16.070 -13.935 -5.895 1.00 42.09 C ATOM 50 O LYS A 368 -15.268 -14.846 -6.088 1.00 42.03 O ATOM 51 CB LYS A 368 -17.912 -14.446 -4.293 1.00 41.73 C ATOM 52 CG LYS A 368 -18.394 -14.587 -2.865 1.00 60.93 C ATOM 53 CD LYS A 368 -19.778 -15.233 -2.839 1.00 73.73 C ATOM 54 CE LYS A 368 -19.994 -16.082 -1.609 1.00 87.35 C ATOM 55 NZ LYS A 368 -21.307 -16.781 -1.646 1.00 96.28 N ATOM 0 H LYS A 368 -17.597 -12.017 -4.069 1.00 39.85 H new ATOM 0 HA LYS A 368 -15.943 -13.987 -3.826 1.00 39.42 H new ATOM 0 HB2 LYS A 368 -18.603 -14.000 -4.808 1.00 41.73 H new ATOM 0 HB3 LYS A 368 -17.804 -15.333 -4.670 1.00 41.73 H new ATOM 0 HG2 LYS A 368 -17.768 -15.126 -2.357 1.00 60.93 H new ATOM 0 HG3 LYS A 368 -18.428 -13.716 -2.440 1.00 60.93 H new ATOM 0 HD2 LYS A 368 -20.456 -14.540 -2.874 1.00 73.73 H new ATOM 0 HD3 LYS A 368 -19.891 -15.781 -3.631 1.00 73.73 H new ATOM 0 HE2 LYS A 368 -19.281 -16.736 -1.538 1.00 87.35 H new ATOM 0 HE3 LYS A 368 -19.947 -15.523 -0.818 1.00 87.35 H new ATOM 0 HZ1 LYS A 368 -21.403 -17.271 -0.910 1.00 96.28 H new ATOM 0 HZ2 LYS A 368 -21.962 -16.180 -1.690 1.00 96.28 H new ATOM 0 HZ3 LYS A 368 -21.342 -17.310 -2.361 1.00 96.28 H new ATOM 56 N LEU A 369 -16.529 -13.132 -6.878 1.00 37.57 N ATOM 57 CA LEU A 369 -16.147 -13.247 -8.291 1.00 36.20 C ATOM 58 C LEU A 369 -14.802 -12.590 -8.651 1.00 40.27 C ATOM 59 O LEU A 369 -14.373 -12.682 -9.804 1.00 40.01 O ATOM 60 CB LEU A 369 -17.265 -12.713 -9.198 1.00 35.64 C ATOM 61 CG LEU A 369 -18.641 -13.374 -9.111 1.00 39.90 C ATOM 62 CD1 LEU A 369 -19.574 -12.813 -10.193 1.00 39.87 C ATOM 63 CD2 LEU A 369 -18.551 -14.898 -9.239 1.00 42.05 C ATOM 0 H LEU A 369 -17.084 -12.492 -6.730 1.00 37.57 H new ATOM 0 HA LEU A 369 -16.019 -14.196 -8.444 1.00 36.20 H new ATOM 0 HB2 LEU A 369 -17.377 -11.769 -9.006 1.00 35.64 H new ATOM 0 HB3 LEU A 369 -16.960 -12.782 -10.116 1.00 35.64 H new ATOM 0 HG LEU A 369 -19.004 -13.170 -8.235 1.00 39.90 H new ATOM 0 HD11 LEU A 369 -20.442 -13.241 -10.126 1.00 39.87 H new ATOM 0 HD12 LEU A 369 -19.675 -11.856 -10.069 1.00 39.87 H new ATOM 0 HD13 LEU A 369 -19.195 -12.987 -11.069 1.00 39.87 H new ATOM 0 HD21 LEU A 369 -19.440 -15.281 -9.179 1.00 42.05 H new ATOM 0 HD22 LEU A 369 -18.157 -15.128 -10.095 1.00 42.05 H new ATOM 0 HD23 LEU A 369 -17.999 -15.251 -8.524 1.00 42.05 H new ATOM 64 N LEU A 370 -14.129 -11.968 -7.666 1.00 36.49 N ATOM 65 CA LEU A 370 -12.863 -11.267 -7.852 1.00 36.43 C ATOM 66 C LEU A 370 -11.705 -11.999 -7.178 1.00 40.78 C ATOM 67 O LEU A 370 -11.754 -12.241 -5.973 1.00 39.83 O ATOM 68 CB LEU A 370 -12.974 -9.813 -7.324 1.00 36.37 C ATOM 69 CG LEU A 370 -11.704 -8.922 -7.395 1.00 40.63 C ATOM 70 CD1 LEU A 370 -11.331 -8.573 -8.846 1.00 40.61 C ATOM 71 CD2 LEU A 370 -11.870 -7.650 -6.575 1.00 39.15 C ATOM 0 H LEU A 370 -14.411 -11.947 -6.854 1.00 36.49 H new ATOM 0 HA LEU A 370 -12.674 -11.244 -8.803 1.00 36.43 H new ATOM 0 HB2 LEU A 370 -13.679 -9.368 -7.820 1.00 36.37 H new ATOM 0 HB3 LEU A 370 -13.260 -9.852 -6.398 1.00 36.37 H new ATOM 0 HG LEU A 370 -10.978 -9.440 -7.014 1.00 40.63 H new ATOM 0 HD11 LEU A 370 -10.536 -8.017 -8.851 1.00 40.61 H new ATOM 0 HD12 LEU A 370 -11.158 -9.389 -9.341 1.00 40.61 H new ATOM 0 HD13 LEU A 370 -12.064 -8.092 -9.262 1.00 40.61 H new ATOM 0 HD21 LEU A 370 -11.063 -7.116 -6.639 1.00 39.15 H new ATOM 0 HD22 LEU A 370 -12.622 -7.141 -6.916 1.00 39.15 H new ATOM 0 HD23 LEU A 370 -12.031 -7.882 -5.647 1.00 39.15 H new ATOM 72 N THR A 371 -10.650 -12.315 -7.952 1.00 37.11 N ATOM 73 CA THR A 371 -9.463 -12.981 -7.414 1.00 38.09 C ATOM 74 C THR A 371 -8.257 -12.038 -7.524 1.00 43.71 C ATOM 75 O THR A 371 -7.796 -11.770 -8.630 1.00 43.44 O ATOM 76 CB THR A 371 -9.254 -14.364 -8.081 1.00 45.27 C ATOM 77 OG1 THR A 371 -10.488 -15.088 -8.078 1.00 41.09 O ATOM 78 CG2 THR A 371 -8.168 -15.190 -7.398 1.00 44.99 C ATOM 0 H THR A 371 -10.609 -12.148 -8.795 1.00 37.11 H new ATOM 0 HA THR A 371 -9.582 -13.173 -6.471 1.00 38.09 H new ATOM 0 HB THR A 371 -8.959 -14.204 -8.991 1.00 45.27 H new ATOM 0 HG1 THR A 371 -10.375 -15.837 -8.441 1.00 41.09 H new ATOM 0 HG21 THR A 371 -8.077 -16.043 -7.851 1.00 44.99 H new ATOM 0 HG22 THR A 371 -7.325 -14.712 -7.437 1.00 44.99 H new ATOM 0 HG23 THR A 371 -8.411 -15.341 -6.471 1.00 44.99 H new ATOM 79 N LEU A 372 -7.765 -11.525 -6.386 1.00 41.78 N ATOM 80 CA LEU A 372 -6.617 -10.615 -6.352 1.00 42.30 C ATOM 81 C LEU A 372 -5.285 -11.338 -6.165 1.00 51.38 C ATOM 82 O LEU A 372 -5.205 -12.291 -5.382 1.00 51.40 O ATOM 83 CB LEU A 372 -6.769 -9.549 -5.254 1.00 41.87 C ATOM 84 CG LEU A 372 -7.975 -8.593 -5.311 1.00 46.28 C ATOM 85 CD1 LEU A 372 -7.983 -7.671 -4.101 1.00 46.05 C ATOM 86 CD2 LEU A 372 -7.992 -7.765 -6.598 1.00 48.23 C ATOM 0 H LEU A 372 -8.093 -11.699 -5.610 1.00 41.78 H new ATOM 0 HA LEU A 372 -6.606 -10.186 -7.222 1.00 42.30 H new ATOM 0 HB2 LEU A 372 -6.799 -10.009 -4.400 1.00 41.87 H new ATOM 0 HB3 LEU A 372 -5.964 -9.007 -5.257 1.00 41.87 H new ATOM 0 HG LEU A 372 -8.775 -9.142 -5.302 1.00 46.28 H new ATOM 0 HD11 LEU A 372 -8.748 -7.076 -4.152 1.00 46.05 H new ATOM 0 HD12 LEU A 372 -8.040 -8.201 -3.291 1.00 46.05 H new ATOM 0 HD13 LEU A 372 -7.167 -7.147 -4.088 1.00 46.05 H new ATOM 0 HD21 LEU A 372 -8.764 -7.178 -6.595 1.00 48.23 H new ATOM 0 HD22 LEU A 372 -7.182 -7.233 -6.652 1.00 48.23 H new ATOM 0 HD23 LEU A 372 -8.040 -8.358 -7.364 1.00 48.23 H new ATOM 87 N GLU A 373 -4.228 -10.851 -6.850 1.00 50.54 N ATOM 88 CA GLU A 373 -2.868 -11.379 -6.716 1.00 52.02 C ATOM 89 C GLU A 373 -2.214 -10.728 -5.502 1.00 60.63 C ATOM 90 O GLU A 373 -2.630 -9.641 -5.094 1.00 60.88 O ATOM 91 CB GLU A 373 -2.031 -11.057 -7.962 1.00 53.46 C ATOM 92 CG GLU A 373 -2.240 -12.012 -9.126 1.00 65.13 C ATOM 93 CD GLU A 373 -1.315 -11.809 -10.313 1.00 87.73 C ATOM 94 OE1 GLU A 373 -0.354 -11.011 -10.204 1.00 80.06 O ATOM 95 OE2 GLU A 373 -1.549 -12.461 -11.357 1.00 81.26 O1- ATOM 0 H GLU A 373 -4.291 -10.199 -7.408 1.00 50.54 H new ATOM 0 HA GLU A 373 -2.912 -12.342 -6.613 1.00 52.02 H new ATOM 0 HB2 GLU A 373 -2.242 -10.157 -8.255 1.00 53.46 H new ATOM 0 HB3 GLU A 373 -1.092 -11.063 -7.718 1.00 53.46 H new ATOM 0 HG2 GLU A 373 -2.131 -12.920 -8.803 1.00 65.13 H new ATOM 0 HG3 GLU A 373 -3.157 -11.928 -9.432 1.00 65.13 H new ATOM 96 N ASP A 374 -1.186 -11.375 -4.929 1.00 60.60 N ATOM 97 CA ASP A 374 -0.455 -10.812 -3.791 1.00 61.77 C ATOM 98 C ASP A 374 0.492 -9.707 -4.285 1.00 66.50 C ATOM 99 O ASP A 374 0.799 -8.777 -3.535 1.00 65.54 O ATOM 100 CB ASP A 374 0.312 -11.904 -3.029 1.00 64.37 C ATOM 101 CG ASP A 374 0.801 -11.467 -1.660 1.00 81.58 C ATOM 102 OD1 ASP A 374 -0.047 -11.094 -0.815 1.00 83.32 O ATOM 103 OD2 ASP A 374 2.028 -11.527 -1.421 1.00 89.54 O1- ATOM 0 H ASP A 374 -0.899 -12.143 -5.189 1.00 60.60 H new ATOM 0 HA ASP A 374 -1.091 -10.424 -3.170 1.00 61.77 H new ATOM 0 HB2 ASP A 374 -0.262 -12.679 -2.926 1.00 64.37 H new ATOM 0 HB3 ASP A 374 1.073 -12.184 -3.561 1.00 64.37 H new ATOM 104 N LYS A 375 0.923 -9.804 -5.561 1.00 64.39 N ATOM 105 CA LYS A 375 1.798 -8.831 -6.214 1.00 64.60 C ATOM 106 C LYS A 375 1.045 -7.515 -6.487 1.00 67.32 C ATOM 107 O LYS A 375 0.024 -7.493 -7.184 1.00 67.48 O ATOM 108 CB LYS A 375 2.419 -9.411 -7.502 1.00 67.63 C ATOM 109 CG LYS A 375 3.643 -8.643 -8.003 1.00 81.40 C ATOM 110 CD LYS A 375 3.318 -7.750 -9.202 1.00 90.54 C ATOM 111 CE LYS A 375 4.466 -6.837 -9.559 1.00 97.05 C ATOM 112 NZ LYS A 375 4.195 -6.073 -10.804 1.00102.43 N ATOM 0 H LYS A 375 0.703 -10.458 -6.075 1.00 64.39 H new ATOM 0 HA LYS A 375 2.530 -8.631 -5.610 1.00 64.60 H new ATOM 0 HB2 LYS A 375 2.671 -10.334 -7.341 1.00 67.63 H new ATOM 0 HB3 LYS A 375 1.745 -9.418 -8.200 1.00 67.63 H new ATOM 0 HG2 LYS A 375 3.997 -8.098 -7.283 1.00 81.40 H new ATOM 0 HG3 LYS A 375 4.338 -9.273 -8.250 1.00 81.40 H new ATOM 0 HD2 LYS A 375 3.098 -8.305 -9.967 1.00 90.54 H new ATOM 0 HD3 LYS A 375 2.532 -7.217 -9.003 1.00 90.54 H new ATOM 0 HE2 LYS A 375 4.627 -6.219 -8.829 1.00 97.05 H new ATOM 0 HE3 LYS A 375 5.274 -7.362 -9.671 1.00 97.05 H new ATOM 0 HZ1 LYS A 375 4.889 -5.546 -10.986 1.00102.43 H new ATOM 0 HZ2 LYS A 375 4.068 -6.640 -11.479 1.00102.43 H new ATOM 0 HZ3 LYS A 375 3.466 -5.575 -10.694 1.00102.43 H new ATOM 113 N GLU A 376 1.573 -6.433 -5.906 1.00 61.55 N ATOM 114 CA GLU A 376 1.092 -5.063 -5.999 1.00 60.24 C ATOM 115 C GLU A 376 1.750 -4.398 -7.231 1.00 61.67 C ATOM 116 O GLU A 376 2.978 -4.411 -7.348 1.00 61.10 O ATOM 117 CB GLU A 376 1.484 -4.350 -4.694 1.00 61.58 C ATOM 118 CG GLU A 376 1.138 -2.881 -4.585 1.00 72.64 C ATOM 119 CD GLU A 376 1.979 -2.184 -3.535 1.00 96.40 C ATOM 120 OE1 GLU A 376 1.805 -2.492 -2.334 1.00 90.71 O ATOM 121 OE2 GLU A 376 2.855 -1.375 -3.919 1.00 91.94 O1- ATOM 0 H GLU A 376 2.274 -6.492 -5.412 1.00 61.55 H new ATOM 0 HA GLU A 376 0.129 -5.017 -6.110 1.00 60.24 H new ATOM 0 HB2 GLU A 376 1.059 -4.816 -3.957 1.00 61.58 H new ATOM 0 HB3 GLU A 376 2.442 -4.444 -4.575 1.00 61.58 H new ATOM 0 HG2 GLU A 376 1.272 -2.452 -5.445 1.00 72.64 H new ATOM 0 HG3 GLU A 376 0.198 -2.785 -4.364 1.00 72.64 H new ATOM 122 N LEU A 377 0.932 -3.850 -8.153 1.00 56.17 N ATOM 123 CA LEU A 377 1.407 -3.179 -9.370 1.00 55.43 C ATOM 124 C LEU A 377 2.055 -1.823 -9.078 1.00 59.02 C ATOM 125 O LEU A 377 3.040 -1.459 -9.726 1.00 58.05 O ATOM 126 CB LEU A 377 0.259 -2.968 -10.366 1.00 55.25 C ATOM 127 CG LEU A 377 -0.234 -4.163 -11.146 1.00 59.36 C ATOM 128 CD1 LEU A 377 -1.614 -3.889 -11.675 1.00 59.19 C ATOM 129 CD2 LEU A 377 0.719 -4.515 -12.285 1.00 61.65 C ATOM 0 H LEU A 377 0.075 -3.861 -8.082 1.00 56.17 H new ATOM 0 HA LEU A 377 2.078 -3.765 -9.753 1.00 55.43 H new ATOM 0 HB2 LEU A 377 -0.494 -2.601 -9.877 1.00 55.25 H new ATOM 0 HB3 LEU A 377 0.539 -2.293 -11.003 1.00 55.25 H new ATOM 0 HG LEU A 377 -0.268 -4.926 -10.549 1.00 59.36 H new ATOM 0 HD11 LEU A 377 -1.928 -4.658 -12.175 1.00 59.19 H new ATOM 0 HD12 LEU A 377 -2.217 -3.718 -10.934 1.00 59.19 H new ATOM 0 HD13 LEU A 377 -1.590 -3.113 -12.257 1.00 59.19 H new ATOM 0 HD21 LEU A 377 0.377 -5.284 -12.767 1.00 61.65 H new ATOM 0 HD22 LEU A 377 0.792 -3.761 -12.891 1.00 61.65 H new ATOM 0 HD23 LEU A 377 1.594 -4.724 -11.922 1.00 61.65 H new ATOM 130 N GLY A 378 1.452 -1.079 -8.153 1.00 55.95 N ATOM 131 CA GLY A 378 1.893 0.242 -7.725 1.00 55.94 C ATOM 132 C GLY A 378 1.189 0.694 -6.462 1.00 61.17 C ATOM 133 O GLY A 378 0.245 0.040 -6.009 1.00 59.73 O ATOM 0 H GLY A 378 0.745 -1.344 -7.742 1.00 55.95 H new ATOM 0 HA2 GLY A 378 2.851 0.229 -7.573 1.00 55.94 H new ATOM 0 HA3 GLY A 378 1.727 0.883 -8.434 1.00 55.94 H new ATOM 134 N SER A 379 1.648 1.815 -5.877 1.00 60.43 N ATOM 135 CA SER A 379 1.084 2.372 -4.643 1.00 61.32 C ATOM 136 C SER A 379 1.247 3.882 -4.532 1.00 67.30 C ATOM 137 O SER A 379 2.309 4.423 -4.851 1.00 67.17 O ATOM 138 CB SER A 379 1.685 1.695 -3.414 1.00 64.98 C ATOM 139 OG SER A 379 3.094 1.840 -3.380 1.00 73.68 O ATOM 0 H SER A 379 2.303 2.274 -6.193 1.00 60.43 H new ATOM 0 HA SER A 379 0.132 2.191 -4.682 1.00 61.32 H new ATOM 0 HB2 SER A 379 1.299 2.078 -2.611 1.00 64.98 H new ATOM 0 HB3 SER A 379 1.455 0.753 -3.417 1.00 64.98 H new ATOM 0 HG SER A 379 3.398 1.461 -2.695 1.00 73.68 H new ATOM 140 N GLY A 380 0.188 4.533 -4.059 1.00 64.72 N ATOM 141 CA GLY A 380 0.140 5.974 -3.841 1.00 64.72 C ATOM 142 C GLY A 380 -0.367 6.331 -2.458 1.00 68.71 C ATOM 143 O GLY A 380 -0.394 5.476 -1.564 1.00 68.56 O ATOM 0 H GLY A 380 -0.545 4.135 -3.850 1.00 64.72 H new ATOM 0 HA2 GLY A 380 1.027 6.347 -3.964 1.00 64.72 H new ATOM 0 HA3 GLY A 380 -0.434 6.381 -4.509 1.00 64.72 H new ATOM 144 N ASN A 381 -0.777 7.599 -2.268 1.00 65.11 N ATOM 145 CA ASN A 381 -1.306 8.041 -0.974 1.00 64.56 C ATOM 146 C ASN A 381 -2.748 7.559 -0.771 1.00 65.70 C ATOM 147 O ASN A 381 -3.204 7.454 0.371 1.00 65.65 O ATOM 148 CB ASN A 381 -1.168 9.551 -0.780 1.00 67.20 C ATOM 149 CG ASN A 381 -0.996 9.927 0.672 1.00 99.95 C ATOM 150 OD1 ASN A 381 0.093 9.805 1.250 1.00 95.27 O ATOM 151 ND2 ASN A 381 -2.077 10.360 1.307 1.00 94.62 N ATOM 0 H ASN A 381 -0.755 8.209 -2.873 1.00 65.11 H new ATOM 0 HA ASN A 381 -0.764 7.629 -0.283 1.00 64.56 H new ATOM 0 HB2 ASN A 381 -0.407 9.872 -1.288 1.00 67.20 H new ATOM 0 HB3 ASN A 381 -1.954 9.994 -1.136 1.00 67.20 H new ATOM 0 HD21 ASN A 381 -2.033 10.564 2.141 1.00 94.62 H new ATOM 0 HD22 ASN A 381 -2.822 10.437 0.884 1.00 94.62 H new ATOM 152 N PHE A 382 -3.443 7.226 -1.884 1.00 59.59 N ATOM 153 CA PHE A 382 -4.805 6.687 -1.889 1.00 57.72 C ATOM 154 C PHE A 382 -4.819 5.250 -1.352 1.00 57.43 C ATOM 155 O PHE A 382 -5.815 4.817 -0.772 1.00 56.52 O ATOM 156 CB PHE A 382 -5.411 6.725 -3.313 1.00 59.36 C ATOM 157 CG PHE A 382 -4.635 5.977 -4.380 1.00 60.78 C ATOM 158 CD1 PHE A 382 -4.829 4.613 -4.580 1.00 63.63 C ATOM 159 CD2 PHE A 382 -3.729 6.641 -5.199 1.00 62.81 C ATOM 160 CE1 PHE A 382 -4.093 3.920 -5.549 1.00 64.35 C ATOM 161 CE2 PHE A 382 -3.008 5.949 -6.180 1.00 65.40 C ATOM 162 CZ PHE A 382 -3.201 4.595 -6.352 1.00 63.36 C ATOM 0 H PHE A 382 -3.115 7.314 -2.674 1.00 59.59 H new ATOM 0 HA PHE A 382 -5.347 7.244 -1.309 1.00 57.72 H new ATOM 0 HB2 PHE A 382 -6.309 6.360 -3.274 1.00 59.36 H new ATOM 0 HB3 PHE A 382 -5.493 7.652 -3.587 1.00 59.36 H new ATOM 0 HD1 PHE A 382 -5.454 4.157 -4.064 1.00 63.63 H new ATOM 0 HD2 PHE A 382 -3.600 7.556 -5.094 1.00 62.81 H new ATOM 0 HE1 PHE A 382 -4.207 3.003 -5.650 1.00 64.35 H new ATOM 0 HE2 PHE A 382 -2.399 6.403 -6.716 1.00 65.40 H new ATOM 0 HZ PHE A 382 -2.729 4.138 -7.010 1.00 63.36 H new ATOM 163 N GLY A 383 -3.726 4.528 -1.600 1.00 51.27 N ATOM 164 CA GLY A 383 -3.557 3.131 -1.229 1.00 49.69 C ATOM 165 C GLY A 383 -2.702 2.377 -2.226 1.00 49.55 C ATOM 166 O GLY A 383 -1.594 2.818 -2.540 1.00 49.43 O ATOM 0 H GLY A 383 -3.040 4.854 -2.004 1.00 51.27 H new ATOM 0 HA2 GLY A 383 -3.150 3.078 -0.350 1.00 49.69 H new ATOM 0 HA3 GLY A 383 -4.427 2.707 -1.165 1.00 49.69 H new ATOM 167 N THR A 384 -3.218 1.241 -2.744 1.00 43.01 N ATOM 168 CA THR A 384 -2.501 0.373 -3.694 1.00 41.23 C ATOM 169 C THR A 384 -3.311 0.015 -4.960 1.00 39.91 C ATOM 170 O THR A 384 -4.529 0.191 -5.001 1.00 38.48 O ATOM 171 CB THR A 384 -2.077 -0.943 -3.002 1.00 51.57 C ATOM 172 OG1 THR A 384 -3.240 -1.592 -2.487 1.00 52.92 O ATOM 173 CG2 THR A 384 -1.043 -0.737 -1.892 1.00 51.47 C ATOM 0 H THR A 384 -4.005 0.954 -2.547 1.00 43.01 H new ATOM 0 HA THR A 384 -1.731 0.889 -3.979 1.00 41.23 H new ATOM 0 HB THR A 384 -1.645 -1.499 -3.669 1.00 51.57 H new ATOM 0 HG1 THR A 384 -3.017 -2.309 -2.111 1.00 52.92 H new ATOM 0 HG21 THR A 384 -0.817 -1.594 -1.497 1.00 51.47 H new ATOM 0 HG22 THR A 384 -0.244 -0.332 -2.265 1.00 51.47 H new ATOM 0 HG23 THR A 384 -1.412 -0.154 -1.210 1.00 51.47 H new ATOM 174 N VAL A 385 -2.606 -0.505 -5.979 1.00 34.21 N ATOM 175 CA VAL A 385 -3.148 -1.025 -7.232 1.00 32.96 C ATOM 176 C VAL A 385 -2.629 -2.456 -7.363 1.00 36.11 C ATOM 177 O VAL A 385 -1.416 -2.684 -7.298 1.00 36.46 O ATOM 178 CB VAL A 385 -2.841 -0.172 -8.496 1.00 36.49 C ATOM 179 CG1 VAL A 385 -3.531 -0.759 -9.731 1.00 36.06 C ATOM 180 CG2 VAL A 385 -3.253 1.283 -8.300 1.00 35.80 C ATOM 0 H VAL A 385 -1.749 -0.564 -5.948 1.00 34.21 H new ATOM 0 HA VAL A 385 -4.116 -0.991 -7.189 1.00 32.96 H new ATOM 0 HB VAL A 385 -1.882 -0.196 -8.637 1.00 36.49 H new ATOM 0 HG11 VAL A 385 -3.327 -0.213 -10.506 1.00 36.06 H new ATOM 0 HG12 VAL A 385 -3.213 -1.663 -9.880 1.00 36.06 H new ATOM 0 HG13 VAL A 385 -4.491 -0.773 -9.590 1.00 36.06 H new ATOM 0 HG21 VAL A 385 -3.050 1.788 -9.103 1.00 35.80 H new ATOM 0 HG22 VAL A 385 -4.206 1.329 -8.122 1.00 35.80 H new ATOM 0 HG23 VAL A 385 -2.766 1.659 -7.550 1.00 35.80 H new ATOM 181 N LYS A 386 -3.554 -3.417 -7.506 1.00 31.20 N ATOM 182 CA LYS A 386 -3.246 -4.841 -7.637 1.00 30.98 C ATOM 183 C LYS A 386 -3.824 -5.420 -8.905 1.00 33.31 C ATOM 184 O LYS A 386 -4.869 -4.976 -9.381 1.00 31.07 O ATOM 185 CB LYS A 386 -3.828 -5.636 -6.449 1.00 34.07 C ATOM 186 CG LYS A 386 -3.000 -5.571 -5.170 1.00 46.25 C ATOM 187 CD LYS A 386 -3.566 -6.544 -4.150 1.00 54.44 C ATOM 188 CE LYS A 386 -2.678 -6.741 -2.951 1.00 67.33 C ATOM 189 NZ LYS A 386 -3.240 -7.762 -2.027 1.00 76.88 N ATOM 0 H LYS A 386 -4.397 -3.249 -7.529 1.00 31.20 H new ATOM 0 HA LYS A 386 -2.279 -4.915 -7.656 1.00 30.98 H new ATOM 0 HB2 LYS A 386 -4.720 -5.304 -6.260 1.00 34.07 H new ATOM 0 HB3 LYS A 386 -3.921 -6.565 -6.712 1.00 34.07 H new ATOM 0 HG2 LYS A 386 -2.074 -5.790 -5.361 1.00 46.25 H new ATOM 0 HG3 LYS A 386 -3.010 -4.670 -4.812 1.00 46.25 H new ATOM 0 HD2 LYS A 386 -4.432 -6.223 -3.853 1.00 54.44 H new ATOM 0 HD3 LYS A 386 -3.713 -7.402 -4.579 1.00 54.44 H new ATOM 0 HE2 LYS A 386 -1.794 -7.016 -3.242 1.00 67.33 H new ATOM 0 HE3 LYS A 386 -2.573 -5.899 -2.481 1.00 67.33 H new ATOM 0 HZ1 LYS A 386 -2.698 -7.860 -1.328 1.00 76.88 H new ATOM 0 HZ2 LYS A 386 -4.042 -7.499 -1.746 1.00 76.88 H new ATOM 0 HZ3 LYS A 386 -3.316 -8.539 -2.454 1.00 76.88 H new ATOM 190 N LYS A 387 -3.148 -6.441 -9.438 1.00 29.72 N ATOM 191 CA LYS A 387 -3.631 -7.200 -10.580 1.00 28.74 C ATOM 192 C LYS A 387 -4.621 -8.241 -10.013 1.00 33.45 C ATOM 193 O LYS A 387 -4.496 -8.654 -8.857 1.00 33.72 O ATOM 194 CB LYS A 387 -2.457 -7.911 -11.275 1.00 30.91 C ATOM 195 CG LYS A 387 -2.869 -8.658 -12.541 1.00 35.88 C ATOM 196 CD LYS A 387 -1.698 -9.260 -13.278 1.00 34.90 C ATOM 197 CE LYS A 387 -2.204 -10.003 -14.483 1.00 34.56 C ATOM 198 NZ LYS A 387 -1.096 -10.403 -15.393 1.00 36.46 N ATOM 0 H LYS A 387 -2.388 -6.711 -9.139 1.00 29.72 H new ATOM 0 HA LYS A 387 -4.056 -6.625 -11.236 1.00 28.74 H new ATOM 0 HB2 LYS A 387 -1.778 -7.256 -11.500 1.00 30.91 H new ATOM 0 HB3 LYS A 387 -2.053 -8.537 -10.654 1.00 30.91 H new ATOM 0 HG2 LYS A 387 -3.494 -9.362 -12.306 1.00 35.88 H new ATOM 0 HG3 LYS A 387 -3.338 -8.048 -13.132 1.00 35.88 H new ATOM 0 HD2 LYS A 387 -1.080 -8.564 -13.550 1.00 34.90 H new ATOM 0 HD3 LYS A 387 -1.209 -9.862 -12.695 1.00 34.90 H new ATOM 0 HE2 LYS A 387 -2.688 -10.793 -14.196 1.00 34.56 H new ATOM 0 HE3 LYS A 387 -2.833 -9.445 -14.966 1.00 34.56 H new ATOM 0 HZ1 LYS A 387 -1.432 -10.653 -16.178 1.00 36.46 H new ATOM 0 HZ2 LYS A 387 -0.546 -9.714 -15.512 1.00 36.46 H new ATOM 0 HZ3 LYS A 387 -0.647 -11.082 -15.033 1.00 36.46 H new ATOM 199 N GLY A 388 -5.596 -8.622 -10.822 1.00 29.70 N ATOM 200 CA GLY A 388 -6.586 -9.630 -10.476 1.00 29.74 C ATOM 201 C GLY A 388 -7.325 -10.143 -11.694 1.00 33.23 C ATOM 202 O GLY A 388 -7.012 -9.757 -12.828 1.00 29.57 O ATOM 0 H GLY A 388 -5.704 -8.293 -11.609 1.00 29.70 H new ATOM 0 HA2 GLY A 388 -6.149 -10.371 -10.028 1.00 29.74 H new ATOM 0 HA3 GLY A 388 -7.222 -9.255 -9.847 1.00 29.74 H new ATOM 203 N TYR A 389 -8.324 -11.005 -11.461 1.00 32.80 N ATOM 204 CA TYR A 389 -9.175 -11.573 -12.504 1.00 34.85 C ATOM 205 C TYR A 389 -10.612 -11.540 -12.003 1.00 37.55 C ATOM 206 O TYR A 389 -10.864 -11.855 -10.839 1.00 37.36 O ATOM 207 CB TYR A 389 -8.781 -13.037 -12.870 1.00 38.81 C ATOM 208 CG TYR A 389 -7.298 -13.333 -12.897 1.00 43.59 C ATOM 209 CD1 TYR A 389 -6.640 -13.795 -11.763 1.00 46.46 C ATOM 210 CD2 TYR A 389 -6.560 -13.196 -14.071 1.00 45.00 C ATOM 211 CE1 TYR A 389 -5.272 -14.066 -11.780 1.00 49.35 C ATOM 212 CE2 TYR A 389 -5.193 -13.476 -14.104 1.00 45.84 C ATOM 213 CZ TYR A 389 -4.553 -13.915 -12.955 1.00 55.53 C ATOM 214 OH TYR A 389 -3.207 -14.197 -12.965 1.00 56.18 O ATOM 0 H TYR A 389 -8.526 -11.279 -10.671 1.00 32.80 H new ATOM 0 HA TYR A 389 -9.066 -11.046 -13.311 1.00 34.85 H new ATOM 0 HB2 TYR A 389 -9.202 -13.636 -12.233 1.00 38.81 H new ATOM 0 HB3 TYR A 389 -9.151 -13.245 -13.742 1.00 38.81 H new ATOM 0 HD1 TYR A 389 -7.121 -13.926 -10.978 1.00 46.46 H new ATOM 0 HD2 TYR A 389 -6.986 -12.913 -14.847 1.00 45.00 H new ATOM 0 HE1 TYR A 389 -4.843 -14.348 -11.004 1.00 49.35 H new ATOM 0 HE2 TYR A 389 -4.713 -13.369 -14.893 1.00 45.84 H new ATOM 0 HH TYR A 389 -2.802 -13.648 -12.476 1.00 56.18 H new ATOM 215 N TYR A 390 -11.551 -11.166 -12.870 1.00 33.15 N ATOM 216 CA TYR A 390 -12.955 -11.103 -12.494 1.00 32.96 C ATOM 217 C TYR A 390 -13.782 -12.040 -13.361 1.00 36.91 C ATOM 218 O TYR A 390 -13.658 -12.014 -14.587 1.00 35.46 O ATOM 219 CB TYR A 390 -13.491 -9.652 -12.546 1.00 33.98 C ATOM 220 CG TYR A 390 -14.841 -9.488 -11.881 1.00 34.83 C ATOM 221 CD1 TYR A 390 -14.953 -9.406 -10.494 1.00 36.43 C ATOM 222 CD2 TYR A 390 -16.009 -9.434 -12.634 1.00 35.01 C ATOM 223 CE1 TYR A 390 -16.195 -9.292 -9.875 1.00 37.16 C ATOM 224 CE2 TYR A 390 -17.258 -9.319 -12.026 1.00 35.30 C ATOM 225 CZ TYR A 390 -17.345 -9.251 -10.646 1.00 41.42 C ATOM 226 OH TYR A 390 -18.570 -9.127 -10.047 1.00 40.87 O ATOM 0 H TYR A 390 -11.391 -10.944 -13.685 1.00 33.15 H new ATOM 0 HA TYR A 390 -13.035 -11.400 -11.574 1.00 32.96 H new ATOM 0 HB2 TYR A 390 -12.852 -9.062 -12.116 1.00 33.98 H new ATOM 0 HB3 TYR A 390 -13.557 -9.371 -13.472 1.00 33.98 H new ATOM 0 HD1 TYR A 390 -14.184 -9.428 -9.972 1.00 36.43 H new ATOM 0 HD2 TYR A 390 -15.956 -9.475 -13.562 1.00 35.01 H new ATOM 0 HE1 TYR A 390 -16.252 -9.244 -8.948 1.00 37.16 H new ATOM 0 HE2 TYR A 390 -18.029 -9.288 -12.545 1.00 35.30 H new ATOM 0 HH TYR A 390 -19.170 -9.115 -10.635 1.00 40.87 H new ATOM 227 N GLN A 391 -14.616 -12.876 -12.715 1.00 34.60 N ATOM 228 CA GLN A 391 -15.482 -13.839 -13.393 1.00 35.27 C ATOM 229 C GLN A 391 -16.695 -13.154 -14.046 1.00 40.83 C ATOM 230 O GLN A 391 -17.593 -12.677 -13.341 1.00 39.31 O ATOM 231 CB GLN A 391 -15.933 -14.943 -12.406 1.00 37.33 C ATOM 232 CG GLN A 391 -16.916 -15.976 -12.990 1.00 50.47 C ATOM 233 CD GLN A 391 -16.314 -16.752 -14.136 1.00 62.18 C ATOM 234 OE1 GLN A 391 -15.259 -17.390 -14.001 1.00 57.12 O ATOM 235 NE2 GLN A 391 -16.939 -16.660 -15.300 1.00 47.44 N ATOM 0 H GLN A 391 -14.689 -12.893 -11.858 1.00 34.60 H new ATOM 0 HA GLN A 391 -14.969 -14.251 -14.106 1.00 35.27 H new ATOM 0 HB2 GLN A 391 -15.147 -15.411 -12.084 1.00 37.33 H new ATOM 0 HB3 GLN A 391 -16.347 -14.521 -11.637 1.00 37.33 H new ATOM 0 HG2 GLN A 391 -17.188 -16.592 -12.292 1.00 50.47 H new ATOM 0 HG3 GLN A 391 -17.717 -15.522 -13.295 1.00 50.47 H new ATOM 0 HE21 GLN A 391 -17.669 -16.210 -15.362 1.00 47.44 H new ATOM 0 HE22 GLN A 391 -16.615 -17.050 -15.994 1.00 47.44 H new ATOM 236 N MET A 392 -16.730 -13.137 -15.394 1.00 38.44 N ATOM 237 CA MET A 392 -17.836 -12.561 -16.173 1.00 39.63 C ATOM 238 C MET A 392 -18.911 -13.651 -16.384 1.00 44.01 C ATOM 239 O MET A 392 -18.829 -14.707 -15.749 1.00 42.02 O ATOM 240 CB MET A 392 -17.338 -12.000 -17.531 1.00 42.75 C ATOM 241 CG MET A 392 -16.196 -10.998 -17.418 1.00 47.48 C ATOM 242 SD MET A 392 -16.668 -9.412 -16.660 1.00 52.76 S ATOM 243 CE MET A 392 -17.171 -8.504 -18.109 1.00 49.50 C ATOM 0 H MET A 392 -16.102 -13.465 -15.882 1.00 38.44 H new ATOM 0 HA MET A 392 -18.219 -11.816 -15.684 1.00 39.63 H new ATOM 0 HB2 MET A 392 -17.050 -12.740 -18.088 1.00 42.75 H new ATOM 0 HB3 MET A 392 -18.082 -11.575 -17.986 1.00 42.75 H new ATOM 0 HG2 MET A 392 -15.481 -11.395 -16.896 1.00 47.48 H new ATOM 0 HG3 MET A 392 -15.839 -10.828 -18.304 1.00 47.48 H new ATOM 0 HE1 MET A 392 -17.457 -7.614 -17.850 1.00 49.50 H new ATOM 0 HE2 MET A 392 -16.424 -8.437 -18.725 1.00 49.50 H new ATOM 0 HE3 MET A 392 -17.906 -8.966 -18.542 1.00 49.50 H new ATOM 244 N LYS A 393 -19.887 -13.422 -17.295 1.00 42.68 N ATOM 245 CA LYS A 393 -20.952 -14.398 -17.589 1.00 43.71 C ATOM 246 C LYS A 393 -20.369 -15.766 -17.975 1.00 48.81 C ATOM 247 O LYS A 393 -20.934 -16.790 -17.586 1.00 49.30 O ATOM 248 CB LYS A 393 -21.889 -13.889 -18.702 1.00 46.64 C ATOM 249 CG LYS A 393 -22.799 -12.741 -18.286 1.00 59.52 C ATOM 250 CD LYS A 393 -24.209 -13.209 -17.933 1.00 67.86 C ATOM 251 CE LYS A 393 -25.137 -12.057 -17.616 1.00 73.23 C ATOM 252 NZ LYS A 393 -25.471 -11.255 -18.826 1.00 75.55 N ATOM 0 H LYS A 393 -19.944 -12.697 -17.754 1.00 42.68 H new ATOM 0 HA LYS A 393 -21.471 -14.505 -16.776 1.00 43.71 H new ATOM 0 HB2 LYS A 393 -21.351 -13.603 -19.456 1.00 46.64 H new ATOM 0 HB3 LYS A 393 -22.438 -14.627 -19.009 1.00 46.64 H new ATOM 0 HG2 LYS A 393 -22.412 -12.286 -17.522 1.00 59.52 H new ATOM 0 HG3 LYS A 393 -22.848 -12.094 -19.007 1.00 59.52 H new ATOM 0 HD2 LYS A 393 -24.572 -13.719 -18.673 1.00 67.86 H new ATOM 0 HD3 LYS A 393 -24.167 -13.807 -17.170 1.00 67.86 H new ATOM 0 HE2 LYS A 393 -25.954 -12.401 -17.222 1.00 73.23 H new ATOM 0 HE3 LYS A 393 -24.722 -11.483 -16.953 1.00 73.23 H new ATOM 0 HZ1 LYS A 393 -26.083 -10.644 -18.618 1.00 75.55 H new ATOM 0 HZ2 LYS A 393 -24.737 -10.850 -19.125 1.00 75.55 H new ATOM 0 HZ3 LYS A 393 -25.792 -11.792 -19.459 1.00 75.55 H new ATOM 253 N LYS A 394 -19.205 -15.775 -18.692 1.00 44.32 N ATOM 254 CA LYS A 394 -18.520 -16.996 -19.120 1.00 43.19 C ATOM 255 C LYS A 394 -16.989 -16.883 -19.052 1.00 44.32 C ATOM 256 O LYS A 394 -16.330 -17.754 -18.474 1.00 43.16 O ATOM 257 CB LYS A 394 -18.965 -17.362 -20.535 1.00 45.26 C ATOM 258 CG LYS A 394 -18.500 -18.723 -21.007 1.00 44.69 C ATOM 259 CD LYS A 394 -18.984 -18.890 -22.402 1.00 43.95 C ATOM 260 CE LYS A 394 -18.780 -20.274 -22.891 1.00 37.29 C ATOM 261 NZ LYS A 394 -19.599 -20.499 -24.108 1.00 37.34 N ATOM 0 H LYS A 394 -18.803 -15.055 -18.936 1.00 44.32 H new ATOM 0 HA LYS A 394 -18.769 -17.699 -18.500 1.00 43.19 H new ATOM 0 HB2 LYS A 394 -19.934 -17.332 -20.575 1.00 45.26 H new ATOM 0 HB3 LYS A 394 -18.635 -16.689 -21.150 1.00 45.26 H new ATOM 0 HG2 LYS A 394 -17.533 -18.787 -20.970 1.00 44.69 H new ATOM 0 HG3 LYS A 394 -18.853 -19.423 -20.436 1.00 44.69 H new ATOM 0 HD2 LYS A 394 -19.927 -18.666 -22.447 1.00 43.95 H new ATOM 0 HD3 LYS A 394 -18.517 -18.269 -22.983 1.00 43.95 H new ATOM 0 HE2 LYS A 394 -17.842 -20.421 -23.090 1.00 37.29 H new ATOM 0 HE3 LYS A 394 -19.027 -20.910 -22.202 1.00 37.29 H new ATOM 0 HZ1 LYS A 394 -19.283 -21.202 -24.553 1.00 37.34 H new ATOM 0 HZ2 LYS A 394 -20.444 -20.652 -23.873 1.00 37.34 H new ATOM 0 HZ3 LYS A 394 -19.562 -19.778 -24.629 1.00 37.34 H new ATOM 262 N VAL A 395 -16.428 -15.836 -19.676 1.00 38.87 N ATOM 263 CA VAL A 395 -14.974 -15.625 -19.692 1.00 37.11 C ATOM 264 C VAL A 395 -14.492 -15.053 -18.362 1.00 39.26 C ATOM 265 O VAL A 395 -15.306 -14.549 -17.587 1.00 38.34 O ATOM 266 CB VAL A 395 -14.520 -14.747 -20.885 1.00 39.57 C ATOM 267 CG1 VAL A 395 -14.879 -15.395 -22.225 1.00 38.25 C ATOM 268 CG2 VAL A 395 -15.069 -13.315 -20.788 1.00 39.19 C ATOM 0 H VAL A 395 -16.876 -15.235 -20.097 1.00 38.87 H new ATOM 0 HA VAL A 395 -14.560 -16.493 -19.814 1.00 37.11 H new ATOM 0 HB VAL A 395 -13.553 -14.684 -20.839 1.00 39.57 H new ATOM 0 HG11 VAL A 395 -14.583 -14.823 -22.951 1.00 38.25 H new ATOM 0 HG12 VAL A 395 -14.442 -16.258 -22.295 1.00 38.25 H new ATOM 0 HG13 VAL A 395 -15.840 -15.515 -22.280 1.00 38.25 H new ATOM 0 HG21 VAL A 395 -14.764 -12.799 -21.550 1.00 39.19 H new ATOM 0 HG22 VAL A 395 -16.039 -13.340 -20.782 1.00 39.19 H new ATOM 0 HG23 VAL A 395 -14.752 -12.901 -19.970 1.00 39.19 H new ATOM 269 N VAL A 396 -13.179 -15.152 -18.091 1.00 33.94 N ATOM 270 CA VAL A 396 -12.552 -14.500 -16.948 1.00 33.05 C ATOM 271 C VAL A 396 -11.895 -13.232 -17.553 1.00 34.64 C ATOM 272 O VAL A 396 -11.441 -13.274 -18.699 1.00 32.56 O ATOM 273 CB VAL A 396 -11.597 -15.432 -16.161 1.00 37.97 C ATOM 274 CG1 VAL A 396 -10.180 -14.876 -16.045 1.00 38.44 C ATOM 275 CG2 VAL A 396 -12.167 -15.758 -14.784 1.00 38.32 C ATOM 0 H VAL A 396 -12.631 -15.605 -18.575 1.00 33.94 H new ATOM 0 HA VAL A 396 -13.187 -14.259 -16.255 1.00 33.05 H new ATOM 0 HB VAL A 396 -11.530 -16.252 -16.674 1.00 37.97 H new ATOM 0 HG11 VAL A 396 -9.628 -15.498 -15.545 1.00 38.44 H new ATOM 0 HG12 VAL A 396 -9.807 -14.754 -16.932 1.00 38.44 H new ATOM 0 HG13 VAL A 396 -10.204 -14.023 -15.584 1.00 38.44 H new ATOM 0 HG21 VAL A 396 -11.554 -16.341 -14.310 1.00 38.32 H new ATOM 0 HG22 VAL A 396 -12.287 -14.938 -14.281 1.00 38.32 H new ATOM 0 HG23 VAL A 396 -13.023 -16.203 -14.885 1.00 38.32 H new ATOM 276 N LYS A 397 -11.941 -12.102 -16.836 1.00 30.29 N ATOM 277 CA LYS A 397 -11.372 -10.860 -17.344 1.00 29.58 C ATOM 278 C LYS A 397 -10.237 -10.380 -16.447 1.00 30.99 C ATOM 279 O LYS A 397 -10.414 -10.279 -15.234 1.00 29.94 O ATOM 280 CB LYS A 397 -12.476 -9.807 -17.507 1.00 32.96 C ATOM 281 CG LYS A 397 -12.075 -8.619 -18.362 1.00 46.14 C ATOM 282 CD LYS A 397 -13.273 -7.973 -19.033 1.00 47.94 C ATOM 283 CE LYS A 397 -12.911 -6.642 -19.641 1.00 41.26 C ATOM 284 NZ LYS A 397 -12.154 -6.779 -20.912 1.00 41.75 N ATOM 0 H LYS A 397 -12.298 -12.040 -16.056 1.00 30.29 H new ATOM 0 HA LYS A 397 -10.987 -11.017 -18.220 1.00 29.58 H new ATOM 0 HB2 LYS A 397 -13.256 -10.228 -17.900 1.00 32.96 H new ATOM 0 HB3 LYS A 397 -12.738 -9.488 -16.629 1.00 32.96 H new ATOM 0 HG2 LYS A 397 -11.621 -7.963 -17.810 1.00 46.14 H new ATOM 0 HG3 LYS A 397 -11.442 -8.907 -19.039 1.00 46.14 H new ATOM 0 HD2 LYS A 397 -13.617 -8.563 -19.722 1.00 47.94 H new ATOM 0 HD3 LYS A 397 -13.983 -7.851 -18.384 1.00 47.94 H new ATOM 0 HE2 LYS A 397 -13.721 -6.134 -19.805 1.00 41.26 H new ATOM 0 HE3 LYS A 397 -12.381 -6.134 -19.007 1.00 41.26 H new ATOM 0 HZ1 LYS A 397 -12.151 -5.999 -21.341 1.00 41.75 H new ATOM 0 HZ2 LYS A 397 -11.317 -7.023 -20.734 1.00 41.75 H new ATOM 0 HZ3 LYS A 397 -12.540 -7.397 -21.423 1.00 41.75 H new ATOM 285 N THR A 398 -9.053 -10.130 -17.043 1.00 26.26 N ATOM 286 CA THR A 398 -7.878 -9.636 -16.314 1.00 25.22 C ATOM 287 C THR A 398 -8.153 -8.174 -15.948 1.00 27.10 C ATOM 288 O THR A 398 -8.565 -7.393 -16.799 1.00 23.33 O ATOM 289 CB THR A 398 -6.604 -9.760 -17.171 1.00 29.63 C ATOM 290 OG1 THR A 398 -6.530 -11.094 -17.681 1.00 30.38 O ATOM 291 CG2 THR A 398 -5.357 -9.487 -16.367 1.00 32.29 C ATOM 0 H THR A 398 -8.915 -10.245 -17.884 1.00 26.26 H new ATOM 0 HA THR A 398 -7.728 -10.164 -15.514 1.00 25.22 H new ATOM 0 HB THR A 398 -6.654 -9.106 -17.885 1.00 29.63 H new ATOM 0 HG1 THR A 398 -5.840 -11.176 -18.152 1.00 30.38 H new ATOM 0 HG21 THR A 398 -4.578 -9.574 -16.938 1.00 32.29 H new ATOM 0 HG22 THR A 398 -5.394 -8.587 -16.007 1.00 32.29 H new ATOM 0 HG23 THR A 398 -5.296 -10.124 -15.638 1.00 32.29 H new ATOM 292 N VAL A 399 -7.915 -7.818 -14.691 1.00 24.63 N ATOM 293 CA VAL A 399 -8.212 -6.481 -14.185 1.00 24.62 C ATOM 294 C VAL A 399 -7.087 -5.827 -13.398 1.00 27.99 C ATOM 295 O VAL A 399 -6.195 -6.500 -12.885 1.00 26.62 O ATOM 296 CB VAL A 399 -9.549 -6.476 -13.364 1.00 27.47 C ATOM 297 CG1 VAL A 399 -10.763 -6.737 -14.264 1.00 26.96 C ATOM 298 CG2 VAL A 399 -9.503 -7.470 -12.202 1.00 27.24 C ATOM 0 H VAL A 399 -7.575 -8.347 -14.104 1.00 24.63 H new ATOM 0 HA VAL A 399 -8.316 -5.931 -14.977 1.00 24.62 H new ATOM 0 HB VAL A 399 -9.647 -5.588 -12.986 1.00 27.47 H new ATOM 0 HG11 VAL A 399 -11.571 -6.728 -13.728 1.00 26.96 H new ATOM 0 HG12 VAL A 399 -10.817 -6.046 -14.943 1.00 26.96 H new ATOM 0 HG13 VAL A 399 -10.669 -7.603 -14.691 1.00 26.96 H new ATOM 0 HG21 VAL A 399 -10.343 -7.441 -11.717 1.00 27.24 H new ATOM 0 HG22 VAL A 399 -9.360 -8.365 -12.547 1.00 27.24 H new ATOM 0 HG23 VAL A 399 -8.777 -7.235 -11.604 1.00 27.24 H new ATOM 299 N ALA A 400 -7.154 -4.485 -13.305 1.00 25.08 N ATOM 300 CA ALA A 400 -6.277 -3.668 -12.488 1.00 25.13 C ATOM 301 C ALA A 400 -7.231 -3.079 -11.435 1.00 28.84 C ATOM 302 O ALA A 400 -8.295 -2.577 -11.789 1.00 26.98 O ATOM 303 CB ALA A 400 -5.631 -2.583 -13.325 1.00 25.88 C ATOM 0 H ALA A 400 -7.737 -4.023 -13.737 1.00 25.08 H new ATOM 0 HA ALA A 400 -5.542 -4.161 -12.091 1.00 25.13 H new ATOM 0 HB1 ALA A 400 -5.048 -2.046 -12.765 1.00 25.88 H new ATOM 0 HB2 ALA A 400 -5.111 -2.989 -14.036 1.00 25.88 H new ATOM 0 HB3 ALA A 400 -6.319 -2.018 -13.710 1.00 25.88 H new ATOM 304 N VAL A 401 -6.906 -3.256 -10.147 1.00 25.97 N ATOM 305 CA VAL A 401 -7.796 -2.872 -9.047 1.00 25.83 C ATOM 306 C VAL A 401 -7.153 -1.846 -8.118 1.00 31.48 C ATOM 307 O VAL A 401 -6.142 -2.144 -7.484 1.00 30.39 O ATOM 308 CB VAL A 401 -8.270 -4.148 -8.277 1.00 28.53 C ATOM 309 CG1 VAL A 401 -9.216 -3.805 -7.129 1.00 27.70 C ATOM 310 CG2 VAL A 401 -8.907 -5.176 -9.226 1.00 27.81 C ATOM 0 H VAL A 401 -6.162 -3.603 -9.889 1.00 25.97 H new ATOM 0 HA VAL A 401 -8.576 -2.436 -9.424 1.00 25.83 H new ATOM 0 HB VAL A 401 -7.478 -4.551 -7.889 1.00 28.53 H new ATOM 0 HG11 VAL A 401 -9.487 -4.620 -6.678 1.00 27.70 H new ATOM 0 HG12 VAL A 401 -8.763 -3.222 -6.499 1.00 27.70 H new ATOM 0 HG13 VAL A 401 -10.000 -3.354 -7.479 1.00 27.70 H new ATOM 0 HG21 VAL A 401 -9.189 -5.953 -8.719 1.00 27.81 H new ATOM 0 HG22 VAL A 401 -9.676 -4.779 -9.664 1.00 27.81 H new ATOM 0 HG23 VAL A 401 -8.258 -5.445 -9.895 1.00 27.81 H new ATOM 311 N LYS A 402 -7.778 -0.660 -8.016 1.00 30.02 N ATOM 312 CA LYS A 402 -7.354 0.443 -7.161 1.00 31.23 C ATOM 313 C LYS A 402 -8.010 0.212 -5.796 1.00 38.29 C ATOM 314 O LYS A 402 -9.240 0.193 -5.697 1.00 36.91 O ATOM 315 CB LYS A 402 -7.803 1.784 -7.778 1.00 34.35 C ATOM 316 CG LYS A 402 -7.230 3.021 -7.103 1.00 46.37 C ATOM 317 CD LYS A 402 -7.488 4.268 -7.941 1.00 54.30 C ATOM 318 CE LYS A 402 -7.073 5.527 -7.226 1.00 64.76 C ATOM 319 NZ LYS A 402 -7.384 6.744 -8.018 1.00 72.40 N ATOM 0 H LYS A 402 -8.489 -0.478 -8.465 1.00 30.02 H new ATOM 0 HA LYS A 402 -6.389 0.479 -7.070 1.00 31.23 H new ATOM 0 HB2 LYS A 402 -7.550 1.796 -8.714 1.00 34.35 H new ATOM 0 HB3 LYS A 402 -8.771 1.832 -7.745 1.00 34.35 H new ATOM 0 HG2 LYS A 402 -7.628 3.129 -6.225 1.00 46.37 H new ATOM 0 HG3 LYS A 402 -6.276 2.908 -6.970 1.00 46.37 H new ATOM 0 HD2 LYS A 402 -7.004 4.199 -8.779 1.00 54.30 H new ATOM 0 HD3 LYS A 402 -8.431 4.319 -8.161 1.00 54.30 H new ATOM 0 HE2 LYS A 402 -7.525 5.575 -6.369 1.00 64.76 H new ATOM 0 HE3 LYS A 402 -6.121 5.495 -7.043 1.00 64.76 H new ATOM 0 HZ1 LYS A 402 -7.087 7.463 -7.586 1.00 72.40 H new ATOM 0 HZ2 LYS A 402 -6.987 6.691 -8.813 1.00 72.40 H new ATOM 0 HZ3 LYS A 402 -8.265 6.808 -8.130 1.00 72.40 H new ATOM 320 N ILE A 403 -7.183 -0.027 -4.765 1.00 38.39 N ATOM 321 CA ILE A 403 -7.640 -0.334 -3.404 1.00 39.48 C ATOM 322 C ILE A 403 -7.289 0.783 -2.430 1.00 46.14 C ATOM 323 O ILE A 403 -6.114 1.132 -2.276 1.00 45.40 O ATOM 324 CB ILE A 403 -7.135 -1.731 -2.927 1.00 42.50 C ATOM 325 CG1 ILE A 403 -7.399 -2.825 -3.999 1.00 42.44 C ATOM 326 CG2 ILE A 403 -7.754 -2.117 -1.565 1.00 43.14 C ATOM 327 CD1 ILE A 403 -6.516 -4.096 -3.913 1.00 45.24 C ATOM 0 H ILE A 403 -6.327 -0.014 -4.842 1.00 38.39 H new ATOM 0 HA ILE A 403 -8.608 -0.387 -3.424 1.00 39.48 H new ATOM 0 HB ILE A 403 -6.175 -1.668 -2.805 1.00 42.50 H new ATOM 0 HG12 ILE A 403 -8.329 -3.095 -3.936 1.00 42.44 H new ATOM 0 HG13 ILE A 403 -7.277 -2.428 -4.876 1.00 42.44 H new ATOM 0 HG21 ILE A 403 -7.423 -2.988 -1.294 1.00 43.14 H new ATOM 0 HG22 ILE A 403 -7.508 -1.456 -0.899 1.00 43.14 H new ATOM 0 HG23 ILE A 403 -8.720 -2.150 -1.646 1.00 43.14 H new ATOM 0 HD11 ILE A 403 -6.761 -4.709 -4.623 1.00 45.24 H new ATOM 0 HD12 ILE A 403 -5.583 -3.849 -4.008 1.00 45.24 H new ATOM 0 HD13 ILE A 403 -6.650 -4.526 -3.054 1.00 45.24 H new ATOM 328 N LEU A 404 -8.316 1.327 -1.761 1.00 45.60 N ATOM 329 CA LEU A 404 -8.160 2.406 -0.787 1.00 46.92 C ATOM 330 C LEU A 404 -7.431 1.965 0.484 1.00 54.97 C ATOM 331 O LEU A 404 -7.593 0.831 0.933 1.00 54.23 O ATOM 332 CB LEU A 404 -9.529 3.016 -0.464 1.00 46.78 C ATOM 333 CG LEU A 404 -9.803 4.443 -0.950 1.00 51.17 C ATOM 334 CD1 LEU A 404 -9.399 4.655 -2.420 1.00 51.02 C ATOM 335 CD2 LEU A 404 -11.257 4.793 -0.754 1.00 51.91 C ATOM 0 H LEU A 404 -9.131 1.073 -1.865 1.00 45.60 H new ATOM 0 HA LEU A 404 -7.596 3.084 -1.191 1.00 46.92 H new ATOM 0 HB2 LEU A 404 -10.210 2.437 -0.839 1.00 46.78 H new ATOM 0 HB3 LEU A 404 -9.643 3.001 0.499 1.00 46.78 H new ATOM 0 HG LEU A 404 -9.252 5.035 -0.415 1.00 51.17 H new ATOM 0 HD11 LEU A 404 -9.591 5.570 -2.680 1.00 51.02 H new ATOM 0 HD12 LEU A 404 -8.450 4.482 -2.523 1.00 51.02 H new ATOM 0 HD13 LEU A 404 -9.901 4.047 -2.985 1.00 51.02 H new ATOM 0 HD21 LEU A 404 -11.417 5.698 -1.065 1.00 51.91 H new ATOM 0 HD22 LEU A 404 -11.810 4.176 -1.258 1.00 51.91 H new ATOM 0 HD23 LEU A 404 -11.481 4.731 0.188 1.00 51.91 H new ATOM 336 N LYS A 405 -6.584 2.842 1.032 1.00 56.18 N ATOM 337 CA LYS A 405 -5.850 2.531 2.256 1.00 58.23 C ATOM 338 C LYS A 405 -6.799 2.669 3.449 1.00 65.93 C ATOM 339 O LYS A 405 -7.434 3.712 3.620 1.00 64.76 O ATOM 340 CB LYS A 405 -4.605 3.426 2.412 1.00 61.24 C ATOM 341 CG LYS A 405 -3.503 2.778 3.257 1.00 80.46 C ATOM 342 CD LYS A 405 -2.146 2.756 2.541 1.00 92.13 C ATOM 343 CE LYS A 405 -1.908 1.488 1.748 1.00101.88 C ATOM 344 NZ LYS A 405 -0.714 1.606 0.867 1.00109.69 N ATOM 0 H LYS A 405 -6.422 3.622 0.708 1.00 56.18 H new ATOM 0 HA LYS A 405 -5.525 1.618 2.212 1.00 58.23 H new ATOM 0 HB2 LYS A 405 -4.251 3.635 1.533 1.00 61.24 H new ATOM 0 HB3 LYS A 405 -4.866 4.266 2.820 1.00 61.24 H new ATOM 0 HG2 LYS A 405 -3.416 3.261 4.094 1.00 80.46 H new ATOM 0 HG3 LYS A 405 -3.762 1.870 3.479 1.00 80.46 H new ATOM 0 HD2 LYS A 405 -2.090 3.519 1.944 1.00 92.13 H new ATOM 0 HD3 LYS A 405 -1.439 2.857 3.198 1.00 92.13 H new ATOM 0 HE2 LYS A 405 -1.789 0.743 2.357 1.00101.88 H new ATOM 0 HE3 LYS A 405 -2.690 1.291 1.209 1.00101.88 H new ATOM 0 HZ1 LYS A 405 -0.454 0.795 0.608 1.00109.69 H new ATOM 0 HZ2 LYS A 405 -0.920 2.093 0.151 1.00109.69 H new ATOM 0 HZ3 LYS A 405 -0.053 2.000 1.314 1.00109.69 H new ATOM 345 N ASN A 406 -6.939 1.588 4.230 1.00 66.68 N ATOM 346 CA ASN A 406 -7.800 1.557 5.412 1.00 68.26 C ATOM 347 C ASN A 406 -6.942 1.727 6.692 1.00 76.00 C ATOM 348 O ASN A 406 -7.256 1.161 7.744 1.00 75.69 O ATOM 349 CB ASN A 406 -8.651 0.271 5.423 1.00 68.01 C ATOM 350 CG ASN A 406 -10.114 0.494 5.760 1.00 89.62 C ATOM 351 OD1 ASN A 406 -10.860 1.182 5.045 1.00 79.34 O ATOM 352 ND2 ASN A 406 -10.570 -0.127 6.841 1.00 81.46 N ATOM 0 H ASN A 406 -6.530 0.846 4.082 1.00 66.68 H new ATOM 0 HA ASN A 406 -8.423 2.300 5.386 1.00 68.26 H new ATOM 0 HB2 ASN A 406 -8.591 -0.151 4.552 1.00 68.01 H new ATOM 0 HB3 ASN A 406 -8.273 -0.349 6.066 1.00 68.01 H new ATOM 0 HD21 ASN A 406 -11.399 -0.057 7.059 1.00 81.46 H new ATOM 0 HD22 ASN A 406 -10.037 -0.599 7.323 1.00 81.46 H new ATOM 353 N GLU A 407 -5.856 2.535 6.580 1.00 75.32 N ATOM 354 CA GLU A 407 -4.898 2.851 7.647 1.00 76.39 C ATOM 355 C GLU A 407 -5.575 3.735 8.710 1.00 82.40 C ATOM 356 O GLU A 407 -5.594 3.376 9.890 1.00 82.14 O ATOM 357 CB GLU A 407 -3.649 3.535 7.046 1.00 77.92 C ATOM 358 CG GLU A 407 -2.499 3.761 8.019 1.00 91.47 C ATOM 359 CD GLU A 407 -1.668 2.539 8.364 1.00115.84 C ATOM 360 OE1 GLU A 407 -0.974 2.015 7.462 1.00113.06 O ATOM 361 OE2 GLU A 407 -1.677 2.131 9.548 1.00109.70 O1- ATOM 0 H GLU A 407 -5.660 2.926 5.840 1.00 75.32 H new ATOM 0 HA GLU A 407 -4.608 2.033 8.081 1.00 76.39 H new ATOM 0 HB2 GLU A 407 -3.327 2.995 6.307 1.00 77.92 H new ATOM 0 HB3 GLU A 407 -3.914 4.392 6.677 1.00 77.92 H new ATOM 0 HG2 GLU A 407 -1.910 4.435 7.645 1.00 91.47 H new ATOM 0 HG3 GLU A 407 -2.862 4.126 8.841 1.00 91.47 H new ATOM 362 N ALA A 408 -6.142 4.875 8.273 1.00 80.20 N ATOM 363 CA ALA A 408 -6.882 5.830 9.099 1.00 80.36 C ATOM 364 C ALA A 408 -8.194 6.139 8.374 1.00 84.83 C ATOM 365 O ALA A 408 -8.177 6.330 7.153 1.00 84.85 O ATOM 366 CB ALA A 408 -6.068 7.102 9.292 1.00 81.09 C ATOM 0 H ALA A 408 -6.099 5.117 7.449 1.00 80.20 H new ATOM 0 HA ALA A 408 -7.059 5.459 9.978 1.00 80.36 H new ATOM 0 HB1 ALA A 408 -6.568 7.726 9.840 1.00 81.09 H new ATOM 0 HB2 ALA A 408 -5.230 6.887 9.730 1.00 81.09 H new ATOM 0 HB3 ALA A 408 -5.886 7.504 8.428 1.00 81.09 H new ATOM 367 N ASN A 409 -9.331 6.139 9.105 1.00 81.23 N ATOM 368 CA ASN A 409 -10.656 6.393 8.521 1.00 80.93 C ATOM 369 C ASN A 409 -10.762 7.809 7.934 1.00 83.18 C ATOM 370 O ASN A 409 -10.828 8.794 8.678 1.00 82.96 O ATOM 371 CB ASN A 409 -11.783 6.087 9.517 1.00 82.74 C ATOM 372 CG ASN A 409 -13.116 5.853 8.850 1.00112.37 C ATOM 373 OD1 ASN A 409 -13.325 4.854 8.150 1.00106.83 O ATOM 374 ND2 ASN A 409 -14.054 6.767 9.057 1.00106.58 N ATOM 0 H ASN A 409 -9.348 5.991 9.952 1.00 81.23 H new ATOM 0 HA ASN A 409 -10.766 5.779 7.778 1.00 80.93 H new ATOM 0 HB2 ASN A 409 -11.545 5.302 10.035 1.00 82.74 H new ATOM 0 HB3 ASN A 409 -11.865 6.825 10.141 1.00 82.74 H new ATOM 0 HD21 ASN A 409 -14.831 6.674 8.701 1.00106.58 H new ATOM 0 HD22 ASN A 409 -13.885 7.453 9.547 1.00106.58 H new ATOM 375 N ASP A 410 -10.719 7.894 6.587 1.00 77.81 N ATOM 376 CA ASP A 410 -10.749 9.147 5.830 1.00 76.48 C ATOM 377 C ASP A 410 -11.843 9.146 4.732 1.00 76.94 C ATOM 378 O ASP A 410 -11.694 8.456 3.715 1.00 76.25 O ATOM 379 CB ASP A 410 -9.343 9.458 5.258 1.00 78.17 C ATOM 380 CG ASP A 410 -9.209 10.732 4.435 1.00 87.33 C ATOM 381 OD1 ASP A 410 -9.985 11.688 4.678 1.00 87.91 O ATOM 382 OD2 ASP A 410 -8.301 10.791 3.582 1.00 92.95 O1- ATOM 0 H ASP A 410 -10.670 7.199 6.083 1.00 77.81 H new ATOM 0 HA ASP A 410 -10.991 9.861 6.440 1.00 76.48 H new ATOM 0 HB2 ASP A 410 -8.719 9.508 5.999 1.00 78.17 H new ATOM 0 HB3 ASP A 410 -9.068 8.710 4.705 1.00 78.17 H new ATOM 383 N PRO A 411 -12.938 9.928 4.917 1.00 70.72 N ATOM 384 CA PRO A 411 -14.007 9.950 3.900 1.00 69.46 C ATOM 385 C PRO A 411 -13.645 10.670 2.598 1.00 69.75 C ATOM 386 O PRO A 411 -14.307 10.431 1.590 1.00 69.22 O ATOM 387 CB PRO A 411 -15.166 10.636 4.624 1.00 71.41 C ATOM 388 CG PRO A 411 -14.504 11.532 5.608 1.00 76.11 C ATOM 389 CD PRO A 411 -13.271 10.800 6.063 1.00 71.89 C ATOM 0 HA PRO A 411 -14.208 9.053 3.590 1.00 69.46 H new ATOM 0 HB2 PRO A 411 -15.722 11.137 4.007 1.00 71.41 H new ATOM 0 HB3 PRO A 411 -15.741 9.990 5.064 1.00 71.41 H new ATOM 0 HG2 PRO A 411 -14.274 12.383 5.204 1.00 76.11 H new ATOM 0 HG3 PRO A 411 -15.092 11.722 6.356 1.00 76.11 H new ATOM 0 HD2 PRO A 411 -12.547 11.413 6.266 1.00 71.89 H new ATOM 0 HD3 PRO A 411 -13.439 10.284 6.867 1.00 71.89 H new ATOM 390 N ALA A 412 -12.612 11.547 2.621 1.00 63.18 N ATOM 391 CA ALA A 412 -12.145 12.302 1.452 1.00 61.68 C ATOM 392 C ALA A 412 -11.645 11.381 0.334 1.00 61.57 C ATOM 393 O ALA A 412 -11.954 11.638 -0.830 1.00 60.09 O ATOM 394 CB ALA A 412 -11.060 13.290 1.849 1.00 62.42 C ATOM 0 H ALA A 412 -12.162 11.715 3.334 1.00 63.18 H new ATOM 0 HA ALA A 412 -12.907 12.793 1.106 1.00 61.68 H new ATOM 0 HB1 ALA A 412 -10.764 13.779 1.065 1.00 62.42 H new ATOM 0 HB2 ALA A 412 -11.413 13.913 2.504 1.00 62.42 H new ATOM 0 HB3 ALA A 412 -10.309 12.810 2.232 1.00 62.42 H new ATOM 395 N LEU A 413 -10.913 10.294 0.688 1.00 55.96 N ATOM 396 CA LEU A 413 -10.414 9.307 -0.283 1.00 54.57 C ATOM 397 C LEU A 413 -11.562 8.506 -0.907 1.00 54.83 C ATOM 398 O LEU A 413 -11.537 8.251 -2.112 1.00 54.44 O ATOM 399 CB LEU A 413 -9.369 8.362 0.336 1.00 54.75 C ATOM 400 CG LEU A 413 -7.991 8.962 0.647 1.00 59.80 C ATOM 401 CD1 LEU A 413 -7.160 7.998 1.465 1.00 59.83 C ATOM 402 CD2 LEU A 413 -7.238 9.362 -0.631 1.00 62.85 C ATOM 0 H LEU A 413 -10.697 10.117 1.502 1.00 55.96 H new ATOM 0 HA LEU A 413 -9.974 9.808 -0.987 1.00 54.57 H new ATOM 0 HB2 LEU A 413 -9.736 8.004 1.160 1.00 54.75 H new ATOM 0 HB3 LEU A 413 -9.243 7.613 -0.268 1.00 54.75 H new ATOM 0 HG LEU A 413 -8.140 9.768 1.166 1.00 59.80 H new ATOM 0 HD11 LEU A 413 -6.294 8.394 1.651 1.00 59.83 H new ATOM 0 HD12 LEU A 413 -7.614 7.807 2.301 1.00 59.83 H new ATOM 0 HD13 LEU A 413 -7.038 7.174 0.968 1.00 59.83 H new ATOM 0 HD21 LEU A 413 -6.375 9.736 -0.395 1.00 62.85 H new ATOM 0 HD22 LEU A 413 -7.109 8.579 -1.189 1.00 62.85 H new ATOM 0 HD23 LEU A 413 -7.754 10.024 -1.117 1.00 62.85 H new ATOM 403 N LYS A 414 -12.577 8.143 -0.091 1.00 48.85 N ATOM 404 CA LYS A 414 -13.773 7.408 -0.511 1.00 47.75 C ATOM 405 C LYS A 414 -14.552 8.213 -1.553 1.00 49.75 C ATOM 406 O LYS A 414 -14.877 7.683 -2.613 1.00 47.95 O ATOM 407 CB LYS A 414 -14.653 7.059 0.710 1.00 49.97 C ATOM 408 CG LYS A 414 -15.929 6.281 0.376 1.00 63.86 C ATOM 409 CD LYS A 414 -16.757 5.935 1.620 1.00 74.82 C ATOM 410 CE LYS A 414 -17.687 7.041 2.065 1.00 88.15 C ATOM 411 NZ LYS A 414 -18.368 6.704 3.345 1.00 97.24 N ATOM 0 H LYS A 414 -12.578 8.329 0.749 1.00 48.85 H new ATOM 0 HA LYS A 414 -13.500 6.573 -0.923 1.00 47.75 H new ATOM 0 HB2 LYS A 414 -14.125 6.538 1.336 1.00 49.97 H new ATOM 0 HB3 LYS A 414 -14.899 7.881 1.162 1.00 49.97 H new ATOM 0 HG2 LYS A 414 -16.472 6.805 -0.233 1.00 63.86 H new ATOM 0 HG3 LYS A 414 -15.692 5.463 -0.087 1.00 63.86 H new ATOM 0 HD2 LYS A 414 -17.280 5.139 1.438 1.00 74.82 H new ATOM 0 HD3 LYS A 414 -16.154 5.719 2.349 1.00 74.82 H new ATOM 0 HE2 LYS A 414 -17.184 7.864 2.172 1.00 88.15 H new ATOM 0 HE3 LYS A 414 -18.351 7.202 1.377 1.00 88.15 H new ATOM 0 HZ1 LYS A 414 -18.907 7.372 3.580 1.00 97.24 H new ATOM 0 HZ2 LYS A 414 -18.846 5.961 3.240 1.00 97.24 H new ATOM 0 HZ3 LYS A 414 -17.759 6.577 3.981 1.00 97.24 H new ATOM 412 N ASP A 415 -14.806 9.506 -1.260 1.00 45.82 N ATOM 413 CA ASP A 415 -15.527 10.420 -2.144 1.00 45.04 C ATOM 414 C ASP A 415 -14.786 10.628 -3.460 1.00 45.38 C ATOM 415 O ASP A 415 -15.423 10.635 -4.509 1.00 46.09 O ATOM 416 CB ASP A 415 -15.806 11.757 -1.431 1.00 47.55 C ATOM 417 CG ASP A 415 -16.604 11.643 -0.138 1.00 63.71 C ATOM 418 OD1 ASP A 415 -17.186 10.556 0.117 1.00 64.26 O ATOM 419 OD2 ASP A 415 -16.633 12.631 0.629 1.00 73.68 O1- ATOM 0 H ASP A 415 -14.554 9.873 -0.524 1.00 45.82 H new ATOM 0 HA ASP A 415 -16.381 10.015 -2.363 1.00 45.04 H new ATOM 0 HB2 ASP A 415 -14.959 12.187 -1.235 1.00 47.55 H new ATOM 0 HB3 ASP A 415 -16.285 12.339 -2.041 1.00 47.55 H new ATOM 420 N GLU A 416 -13.446 10.745 -3.410 1.00 39.83 N ATOM 421 CA GLU A 416 -12.586 10.895 -4.587 1.00 39.47 C ATOM 422 C GLU A 416 -12.696 9.662 -5.496 1.00 42.66 C ATOM 423 O GLU A 416 -12.843 9.811 -6.706 1.00 41.43 O ATOM 424 CB GLU A 416 -11.122 11.120 -4.172 1.00 40.98 C ATOM 425 CG GLU A 416 -10.816 12.563 -3.800 1.00 56.71 C ATOM 426 CD GLU A 416 -9.582 12.806 -2.950 1.00 85.61 C ATOM 427 OE1 GLU A 416 -8.768 11.869 -2.775 1.00 83.84 O ATOM 428 OE2 GLU A 416 -9.426 13.949 -2.461 1.00 84.71 O1- ATOM 0 H GLU A 416 -13.008 10.738 -2.670 1.00 39.83 H new ATOM 0 HA GLU A 416 -12.887 11.674 -5.081 1.00 39.47 H new ATOM 0 HB2 GLU A 416 -10.915 10.547 -3.417 1.00 40.98 H new ATOM 0 HB3 GLU A 416 -10.541 10.850 -4.900 1.00 40.98 H new ATOM 0 HG2 GLU A 416 -10.723 13.073 -4.620 1.00 56.71 H new ATOM 0 HG3 GLU A 416 -11.583 12.922 -3.328 1.00 56.71 H new ATOM 429 N LEU A 417 -12.664 8.450 -4.902 1.00 39.32 N ATOM 430 CA LEU A 417 -12.777 7.194 -5.645 1.00 39.07 C ATOM 431 C LEU A 417 -14.151 7.034 -6.300 1.00 40.19 C ATOM 432 O LEU A 417 -14.214 6.617 -7.456 1.00 37.63 O ATOM 433 CB LEU A 417 -12.419 5.986 -4.754 1.00 39.68 C ATOM 434 CG LEU A 417 -12.192 4.654 -5.476 1.00 45.02 C ATOM 435 CD1 LEU A 417 -10.778 4.558 -6.031 1.00 45.47 C ATOM 436 CD2 LEU A 417 -12.467 3.486 -4.558 1.00 47.43 C ATOM 0 H LEU A 417 -12.575 8.343 -4.053 1.00 39.32 H new ATOM 0 HA LEU A 417 -12.130 7.226 -6.367 1.00 39.07 H new ATOM 0 HB2 LEU A 417 -11.616 6.203 -4.255 1.00 39.68 H new ATOM 0 HB3 LEU A 417 -13.131 5.864 -4.106 1.00 39.68 H new ATOM 0 HG LEU A 417 -12.815 4.619 -6.219 1.00 45.02 H new ATOM 0 HD11 LEU A 417 -10.664 3.706 -6.481 1.00 45.47 H new ATOM 0 HD12 LEU A 417 -10.628 5.279 -6.662 1.00 45.47 H new ATOM 0 HD13 LEU A 417 -10.139 4.627 -5.304 1.00 45.47 H new ATOM 0 HD21 LEU A 417 -12.317 2.656 -5.037 1.00 47.43 H new ATOM 0 HD22 LEU A 417 -11.873 3.529 -3.792 1.00 47.43 H new ATOM 0 HD23 LEU A 417 -13.388 3.522 -4.255 1.00 47.43 H new ATOM 437 N LEU A 418 -15.239 7.391 -5.578 1.00 37.64 N ATOM 438 CA LEU A 418 -16.615 7.335 -6.085 1.00 38.24 C ATOM 439 C LEU A 418 -16.840 8.357 -7.216 1.00 39.14 C ATOM 440 O LEU A 418 -17.534 8.045 -8.192 1.00 37.86 O ATOM 441 CB LEU A 418 -17.649 7.539 -4.949 1.00 39.25 C ATOM 442 CG LEU A 418 -18.214 6.290 -4.197 1.00 45.64 C ATOM 443 CD1 LEU A 418 -19.017 5.376 -5.106 1.00 49.61 C ATOM 444 CD2 LEU A 418 -17.142 5.512 -3.459 1.00 46.43 C ATOM 0 H LEU A 418 -15.187 7.676 -4.768 1.00 37.64 H new ATOM 0 HA LEU A 418 -16.748 6.447 -6.452 1.00 38.24 H new ATOM 0 HB2 LEU A 418 -17.244 8.120 -4.286 1.00 39.25 H new ATOM 0 HB3 LEU A 418 -18.403 8.020 -5.324 1.00 39.25 H new ATOM 0 HG LEU A 418 -18.821 6.646 -3.530 1.00 45.64 H new ATOM 0 HD11 LEU A 418 -19.345 4.619 -4.596 1.00 49.61 H new ATOM 0 HD12 LEU A 418 -19.768 5.866 -5.476 1.00 49.61 H new ATOM 0 HD13 LEU A 418 -18.452 5.059 -5.827 1.00 49.61 H new ATOM 0 HD21 LEU A 418 -17.544 4.751 -3.012 1.00 46.43 H new ATOM 0 HD22 LEU A 418 -16.475 5.200 -4.091 1.00 46.43 H new ATOM 0 HD23 LEU A 418 -16.720 6.087 -2.802 1.00 46.43 H new ATOM 445 N ALA A 419 -16.235 9.557 -7.100 1.00 35.56 N ATOM 446 CA ALA A 419 -16.344 10.600 -8.139 1.00 35.15 C ATOM 447 C ALA A 419 -15.638 10.147 -9.433 1.00 36.76 C ATOM 448 O ALA A 419 -16.196 10.300 -10.521 1.00 36.91 O ATOM 449 CB ALA A 419 -15.759 11.910 -7.641 1.00 36.21 C ATOM 0 H ALA A 419 -15.756 9.785 -6.423 1.00 35.56 H new ATOM 0 HA ALA A 419 -17.283 10.741 -8.336 1.00 35.15 H new ATOM 0 HB1 ALA A 419 -15.838 12.584 -8.334 1.00 36.21 H new ATOM 0 HB2 ALA A 419 -16.241 12.201 -6.851 1.00 36.21 H new ATOM 0 HB3 ALA A 419 -14.823 11.783 -7.419 1.00 36.21 H new ATOM 450 N GLU A 420 -14.449 9.523 -9.290 1.00 31.86 N ATOM 451 CA GLU A 420 -13.634 8.934 -10.361 1.00 31.06 C ATOM 452 C GLU A 420 -14.452 7.833 -11.092 1.00 33.70 C ATOM 453 O GLU A 420 -14.523 7.832 -12.321 1.00 32.39 O ATOM 454 CB GLU A 420 -12.360 8.354 -9.734 1.00 32.13 C ATOM 455 CG GLU A 420 -11.339 7.802 -10.717 1.00 40.76 C ATOM 456 CD GLU A 420 -10.037 7.376 -10.072 1.00 52.54 C ATOM 457 OE1 GLU A 420 -9.825 7.690 -8.879 1.00 44.97 O ATOM 458 OE2 GLU A 420 -9.215 6.743 -10.771 1.00 41.87 O1- ATOM 0 H GLU A 420 -14.082 9.431 -8.518 1.00 31.86 H new ATOM 0 HA GLU A 420 -13.388 9.606 -11.016 1.00 31.06 H new ATOM 0 HB2 GLU A 420 -11.935 9.047 -9.205 1.00 32.13 H new ATOM 0 HB3 GLU A 420 -12.613 7.645 -9.122 1.00 32.13 H new ATOM 0 HG2 GLU A 420 -11.725 7.041 -11.179 1.00 40.76 H new ATOM 0 HG3 GLU A 420 -11.152 8.476 -11.389 1.00 40.76 H new ATOM 459 N ALA A 421 -15.100 6.932 -10.321 1.00 31.08 N ATOM 460 CA ALA A 421 -15.970 5.863 -10.835 1.00 30.81 C ATOM 461 C ALA A 421 -17.144 6.465 -11.645 1.00 33.68 C ATOM 462 O ALA A 421 -17.429 6.008 -12.761 1.00 32.87 O ATOM 463 CB ALA A 421 -16.505 5.032 -9.666 1.00 31.79 C ATOM 0 H ALA A 421 -15.039 6.932 -9.463 1.00 31.08 H new ATOM 0 HA ALA A 421 -15.454 5.291 -11.424 1.00 30.81 H new ATOM 0 HB1 ALA A 421 -17.079 4.327 -10.005 1.00 31.79 H new ATOM 0 HB2 ALA A 421 -15.762 4.639 -9.182 1.00 31.79 H new ATOM 0 HB3 ALA A 421 -17.014 5.603 -9.069 1.00 31.79 H new ATOM 464 N ASN A 422 -17.773 7.533 -11.112 1.00 30.82 N ATOM 465 CA ASN A 422 -18.874 8.246 -11.773 1.00 31.39 C ATOM 466 C ASN A 422 -18.476 8.839 -13.140 1.00 35.41 C ATOM 467 O ASN A 422 -19.289 8.796 -14.066 1.00 35.57 O ATOM 468 CB ASN A 422 -19.449 9.323 -10.868 1.00 36.26 C ATOM 469 CG ASN A 422 -20.921 9.141 -10.599 1.00 71.28 C ATOM 470 OD1 ASN A 422 -21.762 9.246 -11.502 1.00 66.09 O ATOM 471 ND2 ASN A 422 -21.261 8.866 -9.343 1.00 64.40 N ATOM 0 H ASN A 422 -17.564 7.863 -10.346 1.00 30.82 H new ATOM 0 HA ASN A 422 -19.560 7.583 -11.947 1.00 31.39 H new ATOM 0 HB2 ASN A 422 -18.969 9.321 -10.025 1.00 36.26 H new ATOM 0 HB3 ASN A 422 -19.304 10.192 -11.275 1.00 36.26 H new ATOM 0 HD21 ASN A 422 -22.088 8.755 -9.136 1.00 64.40 H new ATOM 0 HD22 ASN A 422 -20.654 8.799 -8.738 1.00 64.40 H new ATOM 472 N VAL A 423 -17.230 9.359 -13.273 1.00 29.85 N ATOM 473 CA VAL A 423 -16.723 9.887 -14.554 1.00 28.14 C ATOM 474 C VAL A 423 -16.517 8.725 -15.535 1.00 30.46 C ATOM 475 O VAL A 423 -17.036 8.767 -16.646 1.00 28.09 O ATOM 476 CB VAL A 423 -15.429 10.754 -14.395 1.00 31.46 C ATOM 477 CG1 VAL A 423 -14.721 10.977 -15.745 1.00 30.39 C ATOM 478 CG2 VAL A 423 -15.748 12.099 -13.728 1.00 31.05 C ATOM 0 H VAL A 423 -16.666 9.412 -12.626 1.00 29.85 H new ATOM 0 HA VAL A 423 -17.390 10.494 -14.911 1.00 28.14 H new ATOM 0 HB VAL A 423 -14.822 10.261 -13.821 1.00 31.46 H new ATOM 0 HG11 VAL A 423 -13.926 11.516 -15.609 1.00 30.39 H new ATOM 0 HG12 VAL A 423 -14.469 10.120 -16.124 1.00 30.39 H new ATOM 0 HG13 VAL A 423 -15.321 11.435 -16.354 1.00 30.39 H new ATOM 0 HG21 VAL A 423 -14.933 12.618 -13.640 1.00 31.05 H new ATOM 0 HG22 VAL A 423 -16.385 12.588 -14.273 1.00 31.05 H new ATOM 0 HG23 VAL A 423 -16.128 11.943 -12.849 1.00 31.05 H new ATOM 479 N MET A 424 -15.752 7.688 -15.108 1.00 28.71 N ATOM 480 CA MET A 424 -15.408 6.510 -15.916 1.00 28.72 C ATOM 481 C MET A 424 -16.645 5.799 -16.465 1.00 33.84 C ATOM 482 O MET A 424 -16.652 5.432 -17.631 1.00 32.52 O ATOM 483 CB MET A 424 -14.519 5.546 -15.122 1.00 30.81 C ATOM 484 CG MET A 424 -13.074 6.017 -15.030 1.00 34.06 C ATOM 485 SD MET A 424 -11.959 4.787 -14.306 1.00 37.08 S ATOM 486 CE MET A 424 -11.600 3.818 -15.731 1.00 34.48 C ATOM 0 H MET A 424 -15.415 7.661 -14.317 1.00 28.71 H new ATOM 0 HA MET A 424 -14.906 6.826 -16.683 1.00 28.72 H new ATOM 0 HB2 MET A 424 -14.879 5.443 -14.227 1.00 30.81 H new ATOM 0 HB3 MET A 424 -14.544 4.671 -15.540 1.00 30.81 H new ATOM 0 HG2 MET A 424 -12.759 6.246 -15.918 1.00 34.06 H new ATOM 0 HG3 MET A 424 -13.039 6.828 -14.499 1.00 34.06 H new ATOM 0 HE1 MET A 424 -11.941 2.919 -15.605 1.00 34.48 H new ATOM 0 HE2 MET A 424 -12.021 4.217 -16.508 1.00 34.48 H new ATOM 0 HE3 MET A 424 -10.640 3.784 -15.866 1.00 34.48 H new ATOM 487 N GLN A 425 -17.706 5.670 -15.634 1.00 32.91 N ATOM 488 CA GLN A 425 -19.009 5.071 -15.979 1.00 34.19 C ATOM 489 C GLN A 425 -19.656 5.745 -17.205 1.00 36.50 C ATOM 490 O GLN A 425 -20.262 5.061 -18.022 1.00 36.53 O ATOM 491 CB GLN A 425 -19.965 5.211 -14.782 1.00 36.06 C ATOM 492 CG GLN A 425 -20.974 4.071 -14.650 1.00 62.91 C ATOM 493 CD GLN A 425 -22.099 4.395 -13.692 1.00 88.84 C ATOM 494 OE1 GLN A 425 -23.270 4.114 -13.970 1.00 86.23 O ATOM 495 NE2 GLN A 425 -21.783 4.988 -12.541 1.00 81.81 N ATOM 0 H GLN A 425 -17.678 5.944 -14.819 1.00 32.91 H new ATOM 0 HA GLN A 425 -18.852 4.139 -16.195 1.00 34.19 H new ATOM 0 HB2 GLN A 425 -19.441 5.262 -13.967 1.00 36.06 H new ATOM 0 HB3 GLN A 425 -20.447 6.049 -14.862 1.00 36.06 H new ATOM 0 HG2 GLN A 425 -21.346 3.870 -15.523 1.00 62.91 H new ATOM 0 HG3 GLN A 425 -20.516 3.272 -14.346 1.00 62.91 H new ATOM 0 HE21 GLN A 425 -20.962 5.176 -12.365 1.00 81.81 H new ATOM 0 HE22 GLN A 425 -22.400 5.183 -11.974 1.00 81.81 H new ATOM 496 N GLN A 426 -19.526 7.079 -17.323 1.00 31.60 N ATOM 497 CA GLN A 426 -20.107 7.873 -18.410 1.00 30.10 C ATOM 498 C GLN A 426 -19.365 7.791 -19.757 1.00 33.35 C ATOM 499 O GLN A 426 -19.925 8.193 -20.779 1.00 33.11 O ATOM 500 CB GLN A 426 -20.299 9.343 -17.959 1.00 31.45 C ATOM 501 CG GLN A 426 -21.252 9.490 -16.754 1.00 45.83 C ATOM 502 CD GLN A 426 -21.277 10.875 -16.150 1.00 63.31 C ATOM 503 OE1 GLN A 426 -22.023 11.760 -16.589 1.00 61.23 O ATOM 504 NE2 GLN A 426 -20.502 11.082 -15.089 1.00 50.66 N ATOM 0 H GLN A 426 -19.086 7.553 -16.756 1.00 31.60 H new ATOM 0 HA GLN A 426 -20.970 7.468 -18.591 1.00 30.10 H new ATOM 0 HB2 GLN A 426 -19.435 9.720 -17.729 1.00 31.45 H new ATOM 0 HB3 GLN A 426 -20.645 9.861 -18.703 1.00 31.45 H new ATOM 0 HG2 GLN A 426 -22.150 9.254 -17.034 1.00 45.83 H new ATOM 0 HG3 GLN A 426 -20.992 8.854 -16.069 1.00 45.83 H new ATOM 0 HE21 GLN A 426 -19.991 10.453 -14.800 1.00 50.66 H new ATOM 0 HE22 GLN A 426 -20.512 11.845 -14.692 1.00 50.66 H new ATOM 505 N LEU A 427 -18.130 7.260 -19.764 1.00 28.59 N ATOM 506 CA LEU A 427 -17.248 7.200 -20.940 1.00 28.48 C ATOM 507 C LEU A 427 -17.238 5.884 -21.704 1.00 32.54 C ATOM 508 O LEU A 427 -17.183 4.810 -21.113 1.00 33.14 O ATOM 509 CB LEU A 427 -15.816 7.632 -20.565 1.00 27.70 C ATOM 510 CG LEU A 427 -15.702 8.909 -19.718 1.00 31.48 C ATOM 511 CD1 LEU A 427 -14.272 9.101 -19.174 1.00 31.37 C ATOM 512 CD2 LEU A 427 -16.257 10.150 -20.454 1.00 30.14 C ATOM 0 H LEU A 427 -17.774 6.915 -19.061 1.00 28.59 H new ATOM 0 HA LEU A 427 -17.637 7.830 -21.566 1.00 28.48 H new ATOM 0 HB2 LEU A 427 -15.393 6.905 -20.082 1.00 27.70 H new ATOM 0 HB3 LEU A 427 -15.311 7.761 -21.383 1.00 27.70 H new ATOM 0 HG LEU A 427 -16.272 8.798 -18.941 1.00 31.48 H new ATOM 0 HD11 LEU A 427 -14.233 9.913 -18.645 1.00 31.37 H new ATOM 0 HD12 LEU A 427 -14.032 8.343 -18.619 1.00 31.37 H new ATOM 0 HD13 LEU A 427 -13.650 9.168 -19.915 1.00 31.37 H new ATOM 0 HD21 LEU A 427 -16.166 10.931 -19.886 1.00 30.14 H new ATOM 0 HD22 LEU A 427 -15.760 10.288 -21.275 1.00 30.14 H new ATOM 0 HD23 LEU A 427 -17.194 10.010 -20.663 1.00 30.14 H new ATOM 513 N ASP A 428 -17.257 5.981 -23.032 1.00 29.70 N ATOM 514 CA ASP A 428 -17.302 4.828 -23.920 1.00 29.83 C ATOM 515 C ASP A 428 -16.526 5.120 -25.206 1.00 32.58 C ATOM 516 O ASP A 428 -17.064 5.692 -26.158 1.00 32.57 O ATOM 517 CB ASP A 428 -18.777 4.437 -24.193 1.00 32.20 C ATOM 518 CG ASP A 428 -18.967 3.295 -25.166 1.00 45.50 C ATOM 519 OD1 ASP A 428 -18.135 2.357 -25.153 1.00 45.75 O ATOM 520 OD2 ASP A 428 -19.950 3.338 -25.946 1.00 54.53 O1- ATOM 0 H ASP A 428 -17.244 6.734 -23.447 1.00 29.70 H new ATOM 0 HA ASP A 428 -16.872 4.068 -23.497 1.00 29.83 H new ATOM 0 HB2 ASP A 428 -19.195 4.199 -23.351 1.00 32.20 H new ATOM 0 HB3 ASP A 428 -19.246 5.215 -24.533 1.00 32.20 H new ATOM 521 N ASN A 429 -15.241 4.736 -25.217 1.00 28.43 N ATOM 522 CA ASN A 429 -14.343 5.007 -26.338 1.00 27.75 C ATOM 523 C ASN A 429 -13.173 4.020 -26.332 1.00 29.20 C ATOM 524 O ASN A 429 -12.694 3.682 -25.251 1.00 28.01 O ATOM 525 CB ASN A 429 -13.844 6.470 -26.263 1.00 25.88 C ATOM 526 CG ASN A 429 -12.949 6.895 -27.406 1.00 34.00 C ATOM 527 OD1 ASN A 429 -11.732 6.776 -27.337 1.00 29.06 O ATOM 528 ND2 ASN A 429 -13.532 7.358 -28.495 1.00 25.44 N ATOM 0 H ASN A 429 -14.870 4.310 -24.569 1.00 28.43 H new ATOM 0 HA ASN A 429 -14.824 4.890 -27.172 1.00 27.75 H new ATOM 0 HB2 ASN A 429 -14.614 7.060 -26.235 1.00 25.88 H new ATOM 0 HB3 ASN A 429 -13.363 6.592 -25.430 1.00 25.88 H new ATOM 0 HD21 ASN A 429 -13.056 7.583 -29.175 1.00 25.44 H new ATOM 0 HD22 ASN A 429 -14.388 7.435 -28.525 1.00 25.44 H new ATOM 529 N PRO A 430 -12.670 3.580 -27.518 1.00 26.13 N ATOM 530 CA PRO A 430 -11.545 2.619 -27.537 1.00 25.52 C ATOM 531 C PRO A 430 -10.209 3.111 -26.957 1.00 28.33 C ATOM 532 O PRO A 430 -9.368 2.287 -26.579 1.00 28.33 O ATOM 533 CB PRO A 430 -11.388 2.265 -29.022 1.00 27.88 C ATOM 534 CG PRO A 430 -12.631 2.753 -29.702 1.00 32.32 C ATOM 535 CD PRO A 430 -13.146 3.887 -28.888 1.00 27.62 C ATOM 0 HA PRO A 430 -11.758 1.873 -26.954 1.00 25.52 H new ATOM 0 HB2 PRO A 430 -10.599 2.687 -29.397 1.00 27.88 H new ATOM 0 HB3 PRO A 430 -11.281 1.308 -29.141 1.00 27.88 H new ATOM 0 HG2 PRO A 430 -12.438 3.039 -30.608 1.00 32.32 H new ATOM 0 HG3 PRO A 430 -13.291 2.045 -29.763 1.00 32.32 H new ATOM 0 HD2 PRO A 430 -12.801 4.737 -29.203 1.00 27.62 H new ATOM 0 HD3 PRO A 430 -14.114 3.942 -28.925 1.00 27.62 H new ATOM 536 N TYR A 431 -10.042 4.432 -26.811 1.00 24.48 N ATOM 537 CA TYR A 431 -8.794 5.045 -26.317 1.00 23.37 C ATOM 538 C TYR A 431 -8.851 5.543 -24.871 1.00 24.96 C ATOM 539 O TYR A 431 -8.007 6.329 -24.440 1.00 21.54 O ATOM 540 CB TYR A 431 -8.306 6.101 -27.319 1.00 24.52 C ATOM 541 CG TYR A 431 -8.242 5.507 -28.714 1.00 26.62 C ATOM 542 CD1 TYR A 431 -7.334 4.497 -29.018 1.00 27.86 C ATOM 543 CD2 TYR A 431 -9.191 5.843 -29.681 1.00 27.69 C ATOM 544 CE1 TYR A 431 -7.315 3.892 -30.274 1.00 27.92 C ATOM 545 CE2 TYR A 431 -9.160 5.271 -30.952 1.00 28.61 C ATOM 546 CZ TYR A 431 -8.224 4.291 -31.243 1.00 36.37 C ATOM 547 OH TYR A 431 -8.190 3.702 -32.487 1.00 35.73 O ATOM 0 H TYR A 431 -10.656 5.005 -26.997 1.00 24.48 H new ATOM 0 HA TYR A 431 -8.128 4.341 -26.267 1.00 23.37 H new ATOM 0 HB2 TYR A 431 -8.904 6.864 -27.312 1.00 24.52 H new ATOM 0 HB3 TYR A 431 -7.430 6.425 -27.057 1.00 24.52 H new ATOM 0 HD1 TYR A 431 -6.727 4.220 -28.370 1.00 27.86 H new ATOM 0 HD2 TYR A 431 -9.856 6.459 -29.474 1.00 27.69 H new ATOM 0 HE1 TYR A 431 -6.696 3.224 -30.461 1.00 27.92 H new ATOM 0 HE2 TYR A 431 -9.765 5.546 -31.602 1.00 28.61 H new ATOM 0 HH TYR A 431 -8.791 4.034 -32.971 1.00 35.73 H new ATOM 548 N ILE A 432 -9.842 5.045 -24.113 1.00 22.90 N ATOM 549 CA ILE A 432 -10.032 5.378 -22.695 1.00 22.45 C ATOM 550 C ILE A 432 -10.162 4.057 -21.924 1.00 26.49 C ATOM 551 O ILE A 432 -10.877 3.153 -22.383 1.00 26.34 O ATOM 552 CB ILE A 432 -11.255 6.343 -22.505 1.00 24.99 C ATOM 553 CG1 ILE A 432 -10.986 7.705 -23.220 1.00 25.53 C ATOM 554 CG2 ILE A 432 -11.596 6.554 -21.004 1.00 24.12 C ATOM 555 CD1 ILE A 432 -12.059 8.751 -23.113 1.00 32.73 C ATOM 0 H ILE A 432 -10.430 4.496 -24.416 1.00 22.90 H new ATOM 0 HA ILE A 432 -9.272 5.867 -22.341 1.00 22.45 H new ATOM 0 HB ILE A 432 -12.030 5.927 -22.915 1.00 24.99 H new ATOM 0 HG12 ILE A 432 -10.165 8.077 -22.862 1.00 25.53 H new ATOM 0 HG13 ILE A 432 -10.830 7.527 -24.161 1.00 25.53 H new ATOM 0 HG21 ILE A 432 -12.354 7.154 -20.925 1.00 24.12 H new ATOM 0 HG22 ILE A 432 -11.816 5.701 -20.599 1.00 24.12 H new ATOM 0 HG23 ILE A 432 -10.831 6.940 -20.549 1.00 24.12 H new ATOM 0 HD11 ILE A 432 -11.783 9.548 -23.592 1.00 32.73 H new ATOM 0 HD12 ILE A 432 -12.882 8.411 -23.498 1.00 32.73 H new ATOM 0 HD13 ILE A 432 -12.206 8.970 -22.180 1.00 32.73 H new ATOM 556 N VAL A 433 -9.470 3.940 -20.771 1.00 21.53 N ATOM 557 CA VAL A 433 -9.539 2.750 -19.898 1.00 22.28 C ATOM 558 C VAL A 433 -11.022 2.573 -19.443 1.00 28.12 C ATOM 559 O VAL A 433 -11.634 3.523 -18.953 1.00 27.33 O ATOM 560 CB VAL A 433 -8.557 2.850 -18.671 1.00 24.98 C ATOM 561 CG1 VAL A 433 -8.852 1.770 -17.616 1.00 24.52 C ATOM 562 CG2 VAL A 433 -7.097 2.760 -19.123 1.00 24.09 C ATOM 0 H VAL A 433 -8.946 4.554 -20.475 1.00 21.53 H new ATOM 0 HA VAL A 433 -9.250 1.968 -20.394 1.00 22.28 H new ATOM 0 HB VAL A 433 -8.702 3.717 -18.262 1.00 24.98 H new ATOM 0 HG11 VAL A 433 -8.230 1.861 -16.877 1.00 24.52 H new ATOM 0 HG12 VAL A 433 -9.759 1.875 -17.290 1.00 24.52 H new ATOM 0 HG13 VAL A 433 -8.752 0.892 -18.015 1.00 24.52 H new ATOM 0 HG21 VAL A 433 -6.514 2.824 -18.350 1.00 24.09 H new ATOM 0 HG22 VAL A 433 -6.948 1.912 -19.570 1.00 24.09 H new ATOM 0 HG23 VAL A 433 -6.902 3.487 -19.735 1.00 24.09 H new ATOM 563 N ARG A 434 -11.573 1.362 -19.619 1.00 26.38 N ATOM 564 CA ARG A 434 -12.945 1.012 -19.232 1.00 26.20 C ATOM 565 C ARG A 434 -13.020 0.569 -17.765 1.00 28.71 C ATOM 566 O ARG A 434 -12.191 -0.212 -17.321 1.00 27.81 O ATOM 567 CB ARG A 434 -13.494 -0.101 -20.161 1.00 28.16 C ATOM 568 CG ARG A 434 -13.596 0.364 -21.615 1.00 39.48 C ATOM 569 CD ARG A 434 -14.364 -0.582 -22.524 1.00 49.10 C ATOM 570 NE ARG A 434 -14.202 -0.243 -23.946 1.00 55.67 N ATOM 571 CZ ARG A 434 -14.916 0.675 -24.603 1.00 62.24 C ATOM 572 NH1 ARG A 434 -14.702 0.893 -25.898 1.00 42.84 N ATOM 573 NH2 ARG A 434 -15.840 1.387 -23.968 1.00 37.77 N ATOM 0 H ARG A 434 -11.146 0.707 -19.976 1.00 26.38 H new ATOM 0 HA ARG A 434 -13.494 1.806 -19.328 1.00 26.20 H new ATOM 0 HB2 ARG A 434 -12.915 -0.878 -20.111 1.00 28.16 H new ATOM 0 HB3 ARG A 434 -14.369 -0.379 -19.849 1.00 28.16 H new ATOM 0 HG2 ARG A 434 -14.024 1.234 -21.636 1.00 39.48 H new ATOM 0 HG3 ARG A 434 -12.701 0.480 -21.970 1.00 39.48 H new ATOM 0 HD2 ARG A 434 -14.059 -1.491 -22.373 1.00 49.10 H new ATOM 0 HD3 ARG A 434 -15.306 -0.556 -22.293 1.00 49.10 H new ATOM 0 HE ARG A 434 -13.601 -0.669 -24.389 1.00 55.67 H new ATOM 0 HH11 ARG A 434 -14.101 0.442 -26.317 1.00 42.84 H new ATOM 0 HH12 ARG A 434 -15.164 1.485 -26.317 1.00 42.84 H new ATOM 0 HH21 ARG A 434 -15.981 1.258 -23.130 1.00 37.77 H new ATOM 0 HH22 ARG A 434 -16.297 1.977 -24.395 1.00 37.77 H new ATOM 574 N MET A 435 -14.007 1.066 -17.020 1.00 26.47 N ATOM 575 CA MET A 435 -14.220 0.628 -15.641 1.00 28.25 C ATOM 576 C MET A 435 -15.141 -0.617 -15.669 1.00 31.42 C ATOM 577 O MET A 435 -16.118 -0.636 -16.416 1.00 30.74 O ATOM 578 CB MET A 435 -14.868 1.756 -14.800 1.00 31.35 C ATOM 579 CG MET A 435 -15.207 1.345 -13.369 1.00 36.05 C ATOM 580 SD MET A 435 -16.215 2.534 -12.426 1.00 41.22 S ATOM 581 CE MET A 435 -17.739 2.452 -13.321 1.00 38.11 C ATOM 0 H MET A 435 -14.565 1.659 -17.295 1.00 26.47 H new ATOM 0 HA MET A 435 -13.369 0.408 -15.231 1.00 28.25 H new ATOM 0 HB2 MET A 435 -14.265 2.515 -14.775 1.00 31.35 H new ATOM 0 HB3 MET A 435 -15.679 2.052 -15.243 1.00 31.35 H new ATOM 0 HG2 MET A 435 -15.677 0.497 -13.396 1.00 36.05 H new ATOM 0 HG3 MET A 435 -14.378 1.195 -12.888 1.00 36.05 H new ATOM 0 HE1 MET A 435 -18.452 2.828 -12.781 1.00 38.11 H new ATOM 0 HE2 MET A 435 -17.658 2.956 -14.146 1.00 38.11 H new ATOM 0 HE3 MET A 435 -17.944 1.527 -13.527 1.00 38.11 H new ATOM 582 N ILE A 436 -14.833 -1.644 -14.862 1.00 28.52 N ATOM 583 CA ILE A 436 -15.719 -2.819 -14.774 1.00 27.81 C ATOM 584 C ILE A 436 -16.815 -2.508 -13.733 1.00 31.92 C ATOM 585 O ILE A 436 -17.989 -2.758 -13.974 1.00 31.56 O ATOM 586 CB ILE A 436 -14.963 -4.156 -14.502 1.00 30.04 C ATOM 587 CG1 ILE A 436 -13.847 -4.441 -15.562 1.00 29.27 C ATOM 588 CG2 ILE A 436 -15.943 -5.351 -14.367 1.00 32.29 C ATOM 589 CD1 ILE A 436 -14.293 -4.400 -17.069 1.00 27.91 C ATOM 0 H ILE A 436 -14.131 -1.681 -14.367 1.00 28.52 H new ATOM 0 HA ILE A 436 -16.130 -2.974 -15.639 1.00 27.81 H new ATOM 0 HB ILE A 436 -14.513 -4.050 -13.649 1.00 30.04 H new ATOM 0 HG12 ILE A 436 -13.136 -3.794 -15.437 1.00 29.27 H new ATOM 0 HG13 ILE A 436 -13.470 -5.316 -15.380 1.00 29.27 H new ATOM 0 HG21 ILE A 436 -15.441 -6.164 -14.199 1.00 32.29 H new ATOM 0 HG22 ILE A 436 -16.552 -5.189 -13.629 1.00 32.29 H new ATOM 0 HG23 ILE A 436 -16.450 -5.448 -15.188 1.00 32.29 H new ATOM 0 HD11 ILE A 436 -13.530 -4.589 -17.638 1.00 27.91 H new ATOM 0 HD12 ILE A 436 -14.982 -5.066 -17.221 1.00 27.91 H new ATOM 0 HD13 ILE A 436 -14.642 -3.520 -17.279 1.00 27.91 H new ATOM 590 N GLY A 437 -16.411 -1.917 -12.611 1.00 29.46 N ATOM 591 CA GLY A 437 -17.329 -1.527 -11.548 1.00 28.69 C ATOM 592 C GLY A 437 -16.593 -1.292 -10.253 1.00 33.61 C ATOM 593 O GLY A 437 -15.364 -1.174 -10.242 1.00 31.80 O ATOM 0 H GLY A 437 -15.588 -1.730 -12.445 1.00 29.46 H new ATOM 0 HA2 GLY A 437 -17.802 -0.720 -11.805 1.00 28.69 H new ATOM 0 HA3 GLY A 437 -17.996 -2.220 -11.423 1.00 28.69 H new ATOM 594 N ILE A 438 -17.349 -1.212 -9.149 1.00 30.30 N ATOM 595 CA ILE A 438 -16.791 -0.961 -7.828 1.00 30.77 C ATOM 596 C ILE A 438 -17.121 -2.107 -6.865 1.00 37.42 C ATOM 597 O ILE A 438 -18.116 -2.804 -7.067 1.00 36.93 O ATOM 598 CB ILE A 438 -17.249 0.437 -7.286 1.00 33.24 C ATOM 599 CG1 ILE A 438 -18.789 0.522 -7.123 1.00 34.36 C ATOM 600 CG2 ILE A 438 -16.711 1.577 -8.159 1.00 32.54 C ATOM 601 CD1 ILE A 438 -19.326 1.861 -6.432 1.00 44.56 C ATOM 0 H ILE A 438 -18.204 -1.303 -9.154 1.00 30.30 H new ATOM 0 HA ILE A 438 -15.824 -0.930 -7.900 1.00 30.77 H new ATOM 0 HB ILE A 438 -16.866 0.539 -6.401 1.00 33.24 H new ATOM 0 HG12 ILE A 438 -19.198 0.440 -7.999 1.00 34.36 H new ATOM 0 HG13 ILE A 438 -19.087 -0.238 -6.599 1.00 34.36 H new ATOM 0 HG21 ILE A 438 -17.009 2.428 -7.801 1.00 32.54 H new ATOM 0 HG22 ILE A 438 -15.741 1.551 -8.164 1.00 32.54 H new ATOM 0 HG23 ILE A 438 -17.041 1.475 -9.065 1.00 32.54 H new ATOM 0 HD11 ILE A 438 -20.294 1.828 -6.371 1.00 44.56 H new ATOM 0 HD12 ILE A 438 -18.949 1.940 -5.542 1.00 44.56 H new ATOM 0 HD13 ILE A 438 -19.062 2.628 -6.963 1.00 44.56 H new ATOM 602 N CYS A 439 -16.311 -2.270 -5.800 1.00 37.13 N ATOM 603 CA CYS A 439 -16.524 -3.305 -4.785 1.00 38.77 C ATOM 604 C CYS A 439 -16.259 -2.780 -3.368 1.00 42.41 C ATOM 605 O CYS A 439 -15.238 -2.126 -3.143 1.00 41.11 O ATOM 606 CB CYS A 439 -15.686 -4.548 -5.092 1.00 40.18 C ATOM 607 SG CYS A 439 -16.171 -6.023 -4.151 1.00 45.10 S ATOM 0 H CYS A 439 -15.622 -1.777 -5.653 1.00 37.13 H new ATOM 0 HA CYS A 439 -17.459 -3.560 -4.818 1.00 38.77 H new ATOM 0 HB2 CYS A 439 -15.753 -4.745 -6.039 1.00 40.18 H new ATOM 0 HB3 CYS A 439 -14.754 -4.351 -4.908 1.00 40.18 H new ATOM 0 HG CYS A 439 -15.465 -6.944 -4.457 1.00 45.10 H new ATOM 608 N GLU A 440 -17.182 -3.061 -2.415 1.00 40.01 N ATOM 609 CA GLU A 440 -17.003 -2.675 -1.008 1.00 39.87 C ATOM 610 C GLU A 440 -16.764 -3.948 -0.177 1.00 44.82 C ATOM 611 O GLU A 440 -17.696 -4.725 0.062 1.00 43.55 O ATOM 612 CB GLU A 440 -18.193 -1.842 -0.471 1.00 41.12 C ATOM 613 CG GLU A 440 -17.939 -1.258 0.918 1.00 51.27 C ATOM 614 CD GLU A 440 -19.099 -0.625 1.674 1.00 71.64 C ATOM 615 OE1 GLU A 440 -20.248 -0.646 1.173 1.00 47.22 O ATOM 616 OE2 GLU A 440 -18.847 -0.099 2.782 1.00 73.23 O1- ATOM 0 H GLU A 440 -17.918 -3.476 -2.574 1.00 40.01 H new ATOM 0 HA GLU A 440 -16.230 -2.094 -0.934 1.00 39.87 H new ATOM 0 HB2 GLU A 440 -18.380 -1.119 -1.090 1.00 41.12 H new ATOM 0 HB3 GLU A 440 -18.985 -2.402 -0.441 1.00 41.12 H new ATOM 0 HG2 GLU A 440 -17.580 -1.968 1.473 1.00 51.27 H new ATOM 0 HG3 GLU A 440 -17.244 -0.587 0.831 1.00 51.27 H new ATOM 617 N ALA A 441 -15.505 -4.174 0.232 1.00 42.45 N ATOM 618 CA ALA A 441 -15.134 -5.343 1.033 1.00 42.64 C ATOM 619 C ALA A 441 -14.068 -4.958 2.080 1.00 48.52 C ATOM 620 O ALA A 441 -14.342 -4.063 2.876 1.00 48.25 O ATOM 621 CB ALA A 441 -14.663 -6.466 0.127 1.00 43.21 C ATOM 0 H ALA A 441 -14.846 -3.652 0.051 1.00 42.45 H new ATOM 0 HA ALA A 441 -15.912 -5.663 1.517 1.00 42.64 H new ATOM 0 HB1 ALA A 441 -14.419 -7.236 0.665 1.00 43.21 H new ATOM 0 HB2 ALA A 441 -15.377 -6.711 -0.483 1.00 43.21 H new ATOM 0 HB3 ALA A 441 -13.892 -6.170 -0.381 1.00 43.21 H new ATOM 622 N GLU A 442 -12.854 -5.567 2.065 1.00 46.73 N ATOM 623 CA GLU A 442 -11.761 -5.214 2.995 1.00 47.09 C ATOM 624 C GLU A 442 -11.442 -3.709 2.974 1.00 51.67 C ATOM 625 O GLU A 442 -10.931 -3.168 3.958 1.00 52.35 O ATOM 626 CB GLU A 442 -10.496 -6.069 2.756 1.00 48.52 C ATOM 627 CG GLU A 442 -10.017 -6.136 1.312 1.00 58.19 C ATOM 628 CD GLU A 442 -10.463 -7.361 0.537 1.00 78.10 C ATOM 629 OE1 GLU A 442 -11.685 -7.630 0.485 1.00 53.12 O ATOM 630 OE2 GLU A 442 -9.586 -8.038 -0.047 1.00 79.79 O1- ATOM 0 H GLU A 442 -12.649 -6.194 1.513 1.00 46.73 H new ATOM 0 HA GLU A 442 -12.081 -5.422 3.887 1.00 47.09 H new ATOM 0 HB2 GLU A 442 -9.777 -5.716 3.303 1.00 48.52 H new ATOM 0 HB3 GLU A 442 -10.671 -6.972 3.065 1.00 48.52 H new ATOM 0 HG2 GLU A 442 -10.330 -5.345 0.846 1.00 58.19 H new ATOM 0 HG3 GLU A 442 -9.048 -6.103 1.307 1.00 58.19 H new ATOM 631 N SER A 443 -11.794 -3.045 1.848 1.00 47.34 N ATOM 632 CA SER A 443 -11.672 -1.612 1.555 1.00 46.31 C ATOM 633 C SER A 443 -12.504 -1.290 0.285 1.00 46.01 C ATOM 634 O SER A 443 -13.095 -2.199 -0.299 1.00 43.70 O ATOM 635 CB SER A 443 -10.210 -1.236 1.333 1.00 51.21 C ATOM 636 OG SER A 443 -10.080 0.174 1.275 1.00 62.49 O ATOM 0 H SER A 443 -12.140 -3.468 1.184 1.00 47.34 H new ATOM 0 HA SER A 443 -12.006 -1.098 2.307 1.00 46.31 H new ATOM 0 HB2 SER A 443 -9.664 -1.590 2.052 1.00 51.21 H new ATOM 0 HB3 SER A 443 -9.887 -1.633 0.509 1.00 51.21 H new ATOM 0 HG SER A 443 -9.266 0.381 1.290 1.00 62.49 H new ATOM 637 N TRP A 444 -12.576 -0.005 -0.116 1.00 41.83 N ATOM 638 CA TRP A 444 -13.286 0.401 -1.338 1.00 41.12 C ATOM 639 C TRP A 444 -12.362 0.128 -2.529 1.00 39.30 C ATOM 640 O TRP A 444 -11.184 0.485 -2.480 1.00 37.67 O ATOM 641 CB TRP A 444 -13.709 1.874 -1.291 1.00 40.83 C ATOM 642 CG TRP A 444 -15.031 2.095 -0.617 1.00 42.76 C ATOM 643 CD1 TRP A 444 -15.235 2.463 0.679 1.00 45.94 C ATOM 644 CD2 TRP A 444 -16.333 1.906 -1.192 1.00 42.74 C ATOM 645 NE1 TRP A 444 -16.583 2.529 0.945 1.00 45.71 N ATOM 646 CE2 TRP A 444 -17.281 2.207 -0.189 1.00 46.80 C ATOM 647 CE3 TRP A 444 -16.794 1.527 -2.466 1.00 44.09 C ATOM 648 CZ2 TRP A 444 -18.661 2.147 -0.419 1.00 46.11 C ATOM 649 CZ3 TRP A 444 -18.161 1.472 -2.695 1.00 45.56 C ATOM 650 CH2 TRP A 444 -19.079 1.770 -1.678 1.00 46.33 C ATOM 0 H TRP A 444 -12.216 0.648 0.313 1.00 41.83 H new ATOM 0 HA TRP A 444 -14.105 -0.111 -1.423 1.00 41.12 H new ATOM 0 HB2 TRP A 444 -13.028 2.384 -0.826 1.00 40.83 H new ATOM 0 HB3 TRP A 444 -13.754 2.219 -2.196 1.00 40.83 H new ATOM 0 HD1 TRP A 444 -14.561 2.643 1.294 1.00 45.94 H new ATOM 0 HE1 TRP A 444 -16.932 2.739 1.702 1.00 45.71 H new ATOM 0 HE3 TRP A 444 -16.192 1.317 -3.143 1.00 44.09 H new ATOM 0 HZ2 TRP A 444 -19.272 2.353 0.251 1.00 46.11 H new ATOM 0 HZ3 TRP A 444 -18.474 1.233 -3.538 1.00 45.56 H new ATOM 0 HH2 TRP A 444 -19.990 1.712 -1.856 1.00 46.33 H new ATOM 651 N MET A 445 -12.880 -0.555 -3.563 1.00 33.85 N ATOM 652 CA MET A 445 -12.091 -0.950 -4.732 1.00 33.02 C ATOM 653 C MET A 445 -12.699 -0.492 -6.057 1.00 34.35 C ATOM 654 O MET A 445 -13.900 -0.642 -6.257 1.00 33.52 O ATOM 655 CB MET A 445 -11.895 -2.479 -4.759 1.00 35.75 C ATOM 656 CG MET A 445 -11.151 -3.056 -3.553 1.00 39.72 C ATOM 657 SD MET A 445 -11.111 -4.882 -3.587 1.00 44.43 S ATOM 658 CE MET A 445 -12.671 -5.223 -2.898 1.00 41.93 C ATOM 0 H MET A 445 -13.703 -0.801 -3.601 1.00 33.85 H new ATOM 0 HA MET A 445 -11.235 -0.503 -4.641 1.00 33.02 H new ATOM 0 HB2 MET A 445 -12.766 -2.902 -4.818 1.00 35.75 H new ATOM 0 HB3 MET A 445 -11.410 -2.715 -5.565 1.00 35.75 H new ATOM 0 HG2 MET A 445 -10.244 -2.713 -3.539 1.00 39.72 H new ATOM 0 HG3 MET A 445 -11.580 -2.757 -2.736 1.00 39.72 H new ATOM 0 HE1 MET A 445 -12.564 -5.794 -2.121 1.00 41.93 H new ATOM 0 HE2 MET A 445 -13.096 -4.393 -2.632 1.00 41.93 H new ATOM 0 HE3 MET A 445 -13.224 -5.673 -3.556 1.00 41.93 H new ATOM 659 N LEU A 446 -11.857 0.044 -6.968 1.00 28.52 N ATOM 660 CA LEU A 446 -12.269 0.459 -8.311 1.00 28.43 C ATOM 661 C LEU A 446 -11.613 -0.543 -9.273 1.00 29.19 C ATOM 662 O LEU A 446 -10.392 -0.644 -9.322 1.00 27.72 O ATOM 663 CB LEU A 446 -11.840 1.927 -8.583 1.00 28.95 C ATOM 664 CG LEU A 446 -12.026 2.490 -9.999 1.00 34.81 C ATOM 665 CD1 LEU A 446 -13.444 2.421 -10.418 1.00 35.17 C ATOM 666 CD2 LEU A 446 -11.586 3.939 -10.070 1.00 38.98 C ATOM 0 H LEU A 446 -11.021 0.174 -6.811 1.00 28.52 H new ATOM 0 HA LEU A 446 -13.232 0.450 -8.424 1.00 28.43 H new ATOM 0 HB2 LEU A 446 -12.332 2.497 -7.971 1.00 28.95 H new ATOM 0 HB3 LEU A 446 -10.901 2.008 -8.354 1.00 28.95 H new ATOM 0 HG LEU A 446 -11.480 1.948 -10.591 1.00 34.81 H new ATOM 0 HD11 LEU A 446 -13.535 2.782 -11.314 1.00 35.17 H new ATOM 0 HD12 LEU A 446 -13.739 1.497 -10.411 1.00 35.17 H new ATOM 0 HD13 LEU A 446 -13.988 2.939 -9.805 1.00 35.17 H new ATOM 0 HD21 LEU A 446 -11.713 4.272 -10.972 1.00 38.98 H new ATOM 0 HD22 LEU A 446 -12.115 4.469 -9.453 1.00 38.98 H new ATOM 0 HD23 LEU A 446 -10.648 4.005 -9.830 1.00 38.98 H new ATOM 667 N VAL A 447 -12.435 -1.347 -9.949 1.00 26.18 N ATOM 668 CA VAL A 447 -11.987 -2.453 -10.817 1.00 24.89 C ATOM 669 C VAL A 447 -12.015 -2.032 -12.282 1.00 26.25 C ATOM 670 O VAL A 447 -13.068 -1.690 -12.808 1.00 23.62 O ATOM 671 CB VAL A 447 -12.822 -3.734 -10.537 1.00 27.98 C ATOM 672 CG1 VAL A 447 -12.389 -4.891 -11.433 1.00 27.73 C ATOM 673 CG2 VAL A 447 -12.728 -4.137 -9.065 1.00 27.15 C ATOM 0 H VAL A 447 -13.291 -1.267 -9.918 1.00 26.18 H new ATOM 0 HA VAL A 447 -11.064 -2.670 -10.610 1.00 24.89 H new ATOM 0 HB VAL A 447 -13.747 -3.527 -10.742 1.00 27.98 H new ATOM 0 HG11 VAL A 447 -12.927 -5.673 -11.235 1.00 27.73 H new ATOM 0 HG12 VAL A 447 -12.510 -4.643 -12.363 1.00 27.73 H new ATOM 0 HG13 VAL A 447 -11.454 -5.093 -11.272 1.00 27.73 H new ATOM 0 HG21 VAL A 447 -13.256 -4.937 -8.914 1.00 27.15 H new ATOM 0 HG22 VAL A 447 -11.802 -4.313 -8.836 1.00 27.15 H new ATOM 0 HG23 VAL A 447 -13.067 -3.417 -8.510 1.00 27.15 H new ATOM 674 N MET A 448 -10.840 -2.065 -12.929 1.00 25.02 N ATOM 675 CA MET A 448 -10.683 -1.623 -14.325 1.00 23.56 C ATOM 676 C MET A 448 -10.139 -2.730 -15.214 1.00 26.74 C ATOM 677 O MET A 448 -9.465 -3.621 -14.723 1.00 26.71 O ATOM 678 CB MET A 448 -9.707 -0.436 -14.364 1.00 25.26 C ATOM 679 CG MET A 448 -10.226 0.824 -13.657 1.00 28.66 C ATOM 680 SD MET A 448 -8.903 2.041 -13.354 1.00 32.76 S ATOM 681 CE MET A 448 -8.047 1.262 -11.996 1.00 29.57 C ATOM 0 H MET A 448 -10.111 -2.345 -12.569 1.00 25.02 H new ATOM 0 HA MET A 448 -11.558 -1.370 -14.659 1.00 23.56 H new ATOM 0 HB2 MET A 448 -8.870 -0.704 -13.954 1.00 25.26 H new ATOM 0 HB3 MET A 448 -9.513 -0.219 -15.289 1.00 25.26 H new ATOM 0 HG2 MET A 448 -10.921 1.232 -14.197 1.00 28.66 H new ATOM 0 HG3 MET A 448 -10.633 0.574 -12.813 1.00 28.66 H new ATOM 0 HE1 MET A 448 -7.458 1.906 -11.572 1.00 29.57 H new ATOM 0 HE2 MET A 448 -8.693 0.940 -11.348 1.00 29.57 H new ATOM 0 HE3 MET A 448 -7.523 0.516 -12.328 1.00 29.57 H new ATOM 682 N GLU A 449 -10.409 -2.655 -16.521 1.00 21.83 N ATOM 683 CA GLU A 449 -9.852 -3.556 -17.523 1.00 23.10 C ATOM 684 C GLU A 449 -8.321 -3.306 -17.504 1.00 26.44 C ATOM 685 O GLU A 449 -7.879 -2.150 -17.460 1.00 24.00 O ATOM 686 CB GLU A 449 -10.452 -3.200 -18.894 1.00 25.03 C ATOM 687 CG GLU A 449 -9.861 -3.935 -20.085 1.00 44.10 C ATOM 688 CD GLU A 449 -10.587 -3.743 -21.405 1.00 71.00 C ATOM 689 OE1 GLU A 449 -11.766 -3.319 -21.390 1.00 55.50 O ATOM 690 OE2 GLU A 449 -9.974 -4.036 -22.458 1.00 71.94 O1- ATOM 0 H GLU A 449 -10.935 -2.062 -16.853 1.00 21.83 H new ATOM 0 HA GLU A 449 -10.050 -4.489 -17.346 1.00 23.10 H new ATOM 0 HB2 GLU A 449 -11.405 -3.377 -18.867 1.00 25.03 H new ATOM 0 HB3 GLU A 449 -10.344 -2.247 -19.038 1.00 25.03 H new ATOM 0 HG2 GLU A 449 -8.941 -3.649 -20.196 1.00 44.10 H new ATOM 0 HG3 GLU A 449 -9.840 -4.883 -19.881 1.00 44.10 H new ATOM 691 N MET A 450 -7.537 -4.383 -17.402 1.00 22.16 N ATOM 692 CA MET A 450 -6.092 -4.277 -17.325 1.00 22.17 C ATOM 693 C MET A 450 -5.468 -3.788 -18.657 1.00 26.98 C ATOM 694 O MET A 450 -5.870 -4.253 -19.719 1.00 27.62 O ATOM 695 CB MET A 450 -5.505 -5.647 -16.902 1.00 23.71 C ATOM 696 CG MET A 450 -3.990 -5.749 -17.001 1.00 26.52 C ATOM 697 SD MET A 450 -3.062 -4.676 -15.887 1.00 30.14 S ATOM 698 CE MET A 450 -3.195 -5.569 -14.426 1.00 26.97 C ATOM 0 H MET A 450 -7.834 -5.190 -17.376 1.00 22.16 H new ATOM 0 HA MET A 450 -5.869 -3.608 -16.659 1.00 22.17 H new ATOM 0 HB2 MET A 450 -5.770 -5.830 -15.987 1.00 23.71 H new ATOM 0 HB3 MET A 450 -5.900 -6.339 -17.455 1.00 23.71 H new ATOM 0 HG2 MET A 450 -3.732 -6.668 -16.829 1.00 26.52 H new ATOM 0 HG3 MET A 450 -3.727 -5.547 -17.913 1.00 26.52 H new ATOM 0 HE1 MET A 450 -3.612 -5.017 -13.746 1.00 26.97 H new ATOM 0 HE2 MET A 450 -3.737 -6.359 -14.578 1.00 26.97 H new ATOM 0 HE3 MET A 450 -2.311 -5.836 -14.128 1.00 26.97 H new ATOM 699 N ALA A 451 -4.529 -2.827 -18.587 1.00 23.31 N ATOM 700 CA ALA A 451 -3.709 -2.403 -19.737 1.00 23.46 C ATOM 701 C ALA A 451 -2.320 -2.985 -19.363 1.00 26.99 C ATOM 702 O ALA A 451 -1.604 -2.435 -18.528 1.00 26.70 O ATOM 703 CB ALA A 451 -3.682 -0.882 -19.856 1.00 23.90 C ATOM 0 H ALA A 451 -4.350 -2.400 -17.862 1.00 23.31 H new ATOM 0 HA ALA A 451 -4.035 -2.708 -20.598 1.00 23.46 H new ATOM 0 HB1 ALA A 451 -3.138 -0.626 -20.617 1.00 23.90 H new ATOM 0 HB2 ALA A 451 -4.585 -0.551 -19.979 1.00 23.90 H new ATOM 0 HB3 ALA A 451 -3.305 -0.501 -19.048 1.00 23.90 H new ATOM 704 N GLU A 452 -2.032 -4.190 -19.877 1.00 24.76 N ATOM 705 CA GLU A 452 -0.870 -5.030 -19.548 1.00 25.33 C ATOM 706 C GLU A 452 0.528 -4.411 -19.575 1.00 28.82 C ATOM 707 O GLU A 452 1.339 -4.753 -18.713 1.00 27.95 O ATOM 708 CB GLU A 452 -0.878 -6.350 -20.357 1.00 27.00 C ATOM 709 CG GLU A 452 -2.133 -7.186 -20.173 1.00 34.47 C ATOM 710 CD GLU A 452 -2.234 -8.082 -18.955 1.00 38.12 C ATOM 711 OE1 GLU A 452 -1.302 -8.100 -18.118 1.00 33.88 O ATOM 712 OE2 GLU A 452 -3.271 -8.770 -18.839 1.00 38.64 O1- ATOM 0 H GLU A 452 -2.542 -4.560 -20.463 1.00 24.76 H new ATOM 0 HA GLU A 452 -1.018 -5.183 -18.602 1.00 25.33 H new ATOM 0 HB2 GLU A 452 -0.776 -6.141 -21.299 1.00 27.00 H new ATOM 0 HB3 GLU A 452 -0.108 -6.880 -20.099 1.00 27.00 H new ATOM 0 HG2 GLU A 452 -2.891 -6.581 -20.157 1.00 34.47 H new ATOM 0 HG3 GLU A 452 -2.233 -7.745 -20.959 1.00 34.47 H new ATOM 713 N LEU A 453 0.828 -3.550 -20.569 1.00 24.94 N ATOM 714 CA LEU A 453 2.166 -2.963 -20.689 1.00 24.48 C ATOM 715 C LEU A 453 2.469 -1.721 -19.813 1.00 27.70 C ATOM 716 O LEU A 453 3.619 -1.305 -19.729 1.00 27.93 O ATOM 717 CB LEU A 453 2.625 -2.807 -22.147 1.00 24.80 C ATOM 718 CG LEU A 453 2.520 -4.030 -23.098 1.00 29.87 C ATOM 719 CD1 LEU A 453 3.205 -3.742 -24.403 1.00 29.77 C ATOM 720 CD2 LEU A 453 3.084 -5.302 -22.490 1.00 32.91 C ATOM 0 H LEU A 453 0.272 -3.299 -21.175 1.00 24.94 H new ATOM 0 HA LEU A 453 2.730 -3.640 -20.283 1.00 24.48 H new ATOM 0 HB2 LEU A 453 2.112 -2.084 -22.541 1.00 24.80 H new ATOM 0 HB3 LEU A 453 3.552 -2.523 -22.134 1.00 24.80 H new ATOM 0 HG LEU A 453 1.574 -4.180 -23.250 1.00 29.87 H new ATOM 0 HD11 LEU A 453 3.131 -4.514 -24.985 1.00 29.77 H new ATOM 0 HD12 LEU A 453 2.786 -2.977 -24.827 1.00 29.77 H new ATOM 0 HD13 LEU A 453 4.142 -3.549 -24.241 1.00 29.77 H new ATOM 0 HD21 LEU A 453 2.994 -6.031 -23.123 1.00 32.91 H new ATOM 0 HD22 LEU A 453 4.022 -5.172 -22.279 1.00 32.91 H new ATOM 0 HD23 LEU A 453 2.597 -5.517 -21.679 1.00 32.91 H new ATOM 721 N GLY A 454 1.452 -1.178 -19.144 1.00 23.50 N ATOM 722 CA GLY A 454 1.620 -0.081 -18.193 1.00 22.10 C ATOM 723 C GLY A 454 1.865 1.323 -18.717 1.00 24.61 C ATOM 724 O GLY A 454 1.633 1.597 -19.901 1.00 24.63 O ATOM 0 H GLY A 454 0.637 -1.439 -19.231 1.00 23.50 H new ATOM 0 HA2 GLY A 454 0.825 -0.051 -17.639 1.00 22.10 H new ATOM 0 HA3 GLY A 454 2.362 -0.309 -17.612 1.00 22.10 H new ATOM 725 N PRO A 455 2.340 2.223 -17.806 1.00 20.70 N ATOM 726 CA PRO A 455 2.557 3.640 -18.165 1.00 20.70 C ATOM 727 C PRO A 455 3.530 3.874 -19.300 1.00 23.92 C ATOM 728 O PRO A 455 4.582 3.238 -19.370 1.00 22.63 O ATOM 729 CB PRO A 455 3.058 4.272 -16.863 1.00 23.11 C ATOM 730 CG PRO A 455 2.600 3.375 -15.788 1.00 28.14 C ATOM 731 CD PRO A 455 2.626 1.994 -16.371 1.00 23.39 C ATOM 0 HA PRO A 455 1.737 4.030 -18.507 1.00 20.70 H new ATOM 0 HB2 PRO A 455 4.025 4.352 -16.863 1.00 23.11 H new ATOM 0 HB3 PRO A 455 2.700 5.166 -16.748 1.00 23.11 H new ATOM 0 HG2 PRO A 455 3.180 3.437 -15.013 1.00 28.14 H new ATOM 0 HG3 PRO A 455 1.707 3.612 -15.494 1.00 28.14 H new ATOM 0 HD2 PRO A 455 3.487 1.567 -16.242 1.00 23.39 H new ATOM 0 HD3 PRO A 455 1.960 1.420 -15.961 1.00 23.39 H new ATOM 732 N LEU A 456 3.156 4.802 -20.190 1.00 22.06 N ATOM 733 CA LEU A 456 3.892 5.164 -21.400 1.00 21.66 C ATOM 734 C LEU A 456 5.318 5.690 -21.112 1.00 26.05 C ATOM 735 O LEU A 456 6.248 5.306 -21.812 1.00 23.87 O ATOM 736 CB LEU A 456 3.045 6.174 -22.222 1.00 21.17 C ATOM 737 CG LEU A 456 3.689 6.792 -23.483 1.00 24.37 C ATOM 738 CD1 LEU A 456 3.894 5.741 -24.593 1.00 24.07 C ATOM 739 CD2 LEU A 456 2.883 8.006 -23.963 1.00 23.77 C ATOM 0 H LEU A 456 2.432 5.256 -20.096 1.00 22.06 H new ATOM 0 HA LEU A 456 4.029 4.360 -21.925 1.00 21.66 H new ATOM 0 HB2 LEU A 456 2.228 5.727 -22.493 1.00 21.17 H new ATOM 0 HB3 LEU A 456 2.789 6.900 -21.631 1.00 21.17 H new ATOM 0 HG LEU A 456 4.574 7.110 -23.246 1.00 24.37 H new ATOM 0 HD11 LEU A 456 4.299 6.162 -25.367 1.00 24.07 H new ATOM 0 HD12 LEU A 456 4.476 5.036 -24.268 1.00 24.07 H new ATOM 0 HD13 LEU A 456 3.037 5.363 -24.843 1.00 24.07 H new ATOM 0 HD21 LEU A 456 3.301 8.380 -24.754 1.00 23.77 H new ATOM 0 HD22 LEU A 456 1.978 7.730 -24.176 1.00 23.77 H new ATOM 0 HD23 LEU A 456 2.859 8.676 -23.262 1.00 23.77 H new ATOM 740 N ASN A 457 5.489 6.540 -20.080 1.00 23.32 N ATOM 741 CA ASN A 457 6.806 7.081 -19.732 1.00 23.82 C ATOM 742 C ASN A 457 7.775 5.973 -19.285 1.00 26.07 C ATOM 743 O ASN A 457 8.897 5.915 -19.773 1.00 24.04 O ATOM 744 CB ASN A 457 6.707 8.226 -18.698 1.00 20.27 C ATOM 745 CG ASN A 457 6.090 7.877 -17.359 1.00 31.73 C ATOM 746 OD1 ASN A 457 5.334 6.911 -17.193 1.00 27.03 O ATOM 747 ND2 ASN A 457 6.385 8.687 -16.365 1.00 27.83 N ATOM 0 H ASN A 457 4.850 6.812 -19.573 1.00 23.32 H new ATOM 0 HA ASN A 457 7.178 7.471 -20.539 1.00 23.82 H new ATOM 0 HB2 ASN A 457 7.600 8.570 -18.540 1.00 20.27 H new ATOM 0 HB3 ASN A 457 6.191 8.947 -19.092 1.00 20.27 H new ATOM 0 HD21 ASN A 457 6.051 8.549 -15.585 1.00 27.83 H new ATOM 0 HD22 ASN A 457 6.912 9.354 -16.496 1.00 27.83 H new ATOM 748 N LYS A 458 7.310 5.059 -18.424 1.00 23.94 N ATOM 749 CA LYS A 458 8.098 3.922 -17.946 1.00 23.50 C ATOM 750 C LYS A 458 8.414 2.957 -19.105 1.00 27.97 C ATOM 751 O LYS A 458 9.539 2.430 -19.186 1.00 27.91 O ATOM 752 CB LYS A 458 7.362 3.222 -16.788 1.00 26.82 C ATOM 753 CG LYS A 458 8.158 2.083 -16.125 1.00 48.35 C ATOM 754 CD LYS A 458 7.463 1.482 -14.899 1.00 49.48 C ATOM 755 CE LYS A 458 6.466 0.398 -15.236 1.00 51.44 C ATOM 756 NZ LYS A 458 5.744 -0.065 -14.023 1.00 58.47 N ATOM 0 H LYS A 458 6.515 5.086 -18.098 1.00 23.94 H new ATOM 0 HA LYS A 458 8.948 4.240 -17.603 1.00 23.50 H new ATOM 0 HB2 LYS A 458 7.141 3.883 -16.113 1.00 26.82 H new ATOM 0 HB3 LYS A 458 6.524 2.865 -17.121 1.00 26.82 H new ATOM 0 HG2 LYS A 458 8.309 1.382 -16.778 1.00 48.35 H new ATOM 0 HG3 LYS A 458 9.029 2.418 -15.862 1.00 48.35 H new ATOM 0 HD2 LYS A 458 8.135 1.118 -14.302 1.00 49.48 H new ATOM 0 HD3 LYS A 458 7.008 2.190 -14.416 1.00 49.48 H new ATOM 0 HE2 LYS A 458 5.829 0.732 -15.887 1.00 51.44 H new ATOM 0 HE3 LYS A 458 6.925 -0.351 -15.647 1.00 51.44 H new ATOM 0 HZ1 LYS A 458 5.983 -0.902 -13.836 1.00 58.47 H new ATOM 0 HZ2 LYS A 458 5.949 0.462 -13.336 1.00 58.47 H new ATOM 0 HZ3 LYS A 458 4.867 -0.034 -14.169 1.00 58.47 H new ATOM 757 N TYR A 459 7.450 2.765 -20.022 1.00 24.10 N ATOM 758 CA TYR A 459 7.643 1.886 -21.170 1.00 23.11 C ATOM 759 C TYR A 459 8.786 2.397 -22.035 1.00 27.67 C ATOM 760 O TYR A 459 9.694 1.635 -22.380 1.00 27.62 O ATOM 761 CB TYR A 459 6.363 1.776 -22.029 1.00 23.45 C ATOM 762 CG TYR A 459 6.509 0.724 -23.113 1.00 25.49 C ATOM 763 CD1 TYR A 459 6.341 -0.628 -22.825 1.00 27.03 C ATOM 764 CD2 TYR A 459 6.880 1.076 -24.409 1.00 27.27 C ATOM 765 CE1 TYR A 459 6.488 -1.605 -23.815 1.00 29.67 C ATOM 766 CE2 TYR A 459 7.031 0.108 -25.407 1.00 28.82 C ATOM 767 CZ TYR A 459 6.840 -1.231 -25.102 1.00 36.39 C ATOM 768 OH TYR A 459 7.005 -2.190 -26.072 1.00 39.50 O ATOM 0 H TYR A 459 6.677 3.140 -19.990 1.00 24.10 H new ATOM 0 HA TYR A 459 7.856 1.004 -20.827 1.00 23.11 H new ATOM 0 HB2 TYR A 459 5.609 1.554 -21.461 1.00 23.45 H new ATOM 0 HB3 TYR A 459 6.169 2.636 -22.435 1.00 23.45 H new ATOM 0 HD1 TYR A 459 6.127 -0.886 -21.958 1.00 27.03 H new ATOM 0 HD2 TYR A 459 7.030 1.971 -24.614 1.00 27.27 H new ATOM 0 HE1 TYR A 459 6.350 -2.502 -23.610 1.00 29.67 H new ATOM 0 HE2 TYR A 459 7.259 0.362 -26.272 1.00 28.82 H new ATOM 0 HH TYR A 459 6.503 -2.843 -25.909 1.00 39.50 H new ATOM 769 N LEU A 460 8.708 3.673 -22.425 1.00 23.86 N ATOM 770 CA LEU A 460 9.695 4.307 -23.304 1.00 24.55 C ATOM 771 C LEU A 460 11.075 4.426 -22.652 1.00 29.92 C ATOM 772 O LEU A 460 12.077 4.332 -23.366 1.00 31.71 O ATOM 773 CB LEU A 460 9.186 5.660 -23.834 1.00 23.97 C ATOM 774 CG LEU A 460 7.912 5.626 -24.706 1.00 27.56 C ATOM 775 CD1 LEU A 460 7.395 7.047 -24.965 1.00 27.34 C ATOM 776 CD2 LEU A 460 8.167 4.922 -26.051 1.00 29.07 C ATOM 0 H LEU A 460 8.073 4.200 -22.183 1.00 23.86 H new ATOM 0 HA LEU A 460 9.810 3.720 -24.067 1.00 24.55 H new ATOM 0 HB2 LEU A 460 9.018 6.239 -23.074 1.00 23.97 H new ATOM 0 HB3 LEU A 460 9.897 6.070 -24.352 1.00 23.97 H new ATOM 0 HG LEU A 460 7.242 5.123 -24.216 1.00 27.56 H new ATOM 0 HD11 LEU A 460 6.596 7.006 -25.513 1.00 27.34 H new ATOM 0 HD12 LEU A 460 7.185 7.474 -24.120 1.00 27.34 H new ATOM 0 HD13 LEU A 460 8.077 7.561 -25.426 1.00 27.34 H new ATOM 0 HD21 LEU A 460 7.350 4.917 -26.574 1.00 29.07 H new ATOM 0 HD22 LEU A 460 8.859 5.395 -26.538 1.00 29.07 H new ATOM 0 HD23 LEU A 460 8.452 4.009 -25.890 1.00 29.07 H new ATOM 777 N GLN A 461 11.135 4.601 -21.304 1.00 26.02 N ATOM 778 CA GLN A 461 12.398 4.640 -20.548 1.00 26.15 C ATOM 779 C GLN A 461 13.122 3.282 -20.691 1.00 32.69 C ATOM 780 O GLN A 461 14.357 3.252 -20.771 1.00 31.51 O ATOM 781 CB GLN A 461 12.141 4.871 -19.046 1.00 26.92 C ATOM 782 CG GLN A 461 11.775 6.296 -18.626 1.00 33.64 C ATOM 783 CD GLN A 461 11.176 6.356 -17.219 1.00 53.34 C ATOM 784 OE1 GLN A 461 11.297 5.421 -16.406 1.00 48.23 O ATOM 785 NE2 GLN A 461 10.490 7.454 -16.897 1.00 41.14 N ATOM 0 H GLN A 461 10.436 4.700 -20.812 1.00 26.02 H new ATOM 0 HA GLN A 461 12.933 5.367 -20.903 1.00 26.15 H new ATOM 0 HB2 GLN A 461 11.425 4.279 -18.766 1.00 26.92 H new ATOM 0 HB3 GLN A 461 12.936 4.606 -18.558 1.00 26.92 H new ATOM 0 HG2 GLN A 461 12.568 6.854 -18.661 1.00 33.64 H new ATOM 0 HG3 GLN A 461 11.140 6.664 -19.261 1.00 33.64 H new ATOM 0 HE21 GLN A 461 10.412 8.095 -17.466 1.00 41.14 H new ATOM 0 HE22 GLN A 461 10.126 7.521 -16.121 1.00 41.14 H new ATOM 786 N GLN A 462 12.337 2.167 -20.734 1.00 30.71 N ATOM 787 CA GLN A 462 12.827 0.785 -20.820 1.00 30.97 C ATOM 788 C GLN A 462 12.944 0.245 -22.254 1.00 34.58 C ATOM 789 O GLN A 462 13.501 -0.833 -22.453 1.00 34.19 O ATOM 790 CB GLN A 462 11.947 -0.159 -19.968 1.00 32.60 C ATOM 791 CG GLN A 462 11.933 0.153 -18.471 1.00 54.73 C ATOM 792 CD GLN A 462 13.245 -0.153 -17.786 1.00 86.10 C ATOM 793 OE1 GLN A 462 13.595 -1.318 -17.545 1.00 86.19 O ATOM 794 NE2 GLN A 462 13.989 0.892 -17.439 1.00 76.19 N ATOM 0 H GLN A 462 11.478 2.213 -20.712 1.00 30.71 H new ATOM 0 HA GLN A 462 13.730 0.808 -20.466 1.00 30.97 H new ATOM 0 HB2 GLN A 462 11.037 -0.121 -20.302 1.00 32.60 H new ATOM 0 HB3 GLN A 462 12.257 -1.070 -20.093 1.00 32.60 H new ATOM 0 HG2 GLN A 462 11.720 1.091 -18.344 1.00 54.73 H new ATOM 0 HG3 GLN A 462 11.226 -0.358 -18.047 1.00 54.73 H new ATOM 0 HE21 GLN A 462 13.721 1.689 -17.619 1.00 76.19 H new ATOM 0 HE22 GLN A 462 14.738 0.771 -17.035 1.00 76.19 H new ATOM 795 N ASN A 463 12.406 0.971 -23.242 1.00 30.28 N ATOM 796 CA ASN A 463 12.401 0.556 -24.642 1.00 29.71 C ATOM 797 C ASN A 463 12.806 1.749 -25.494 1.00 36.02 C ATOM 798 O ASN A 463 11.984 2.347 -26.194 1.00 35.66 O ATOM 799 CB ASN A 463 11.022 -0.006 -25.032 1.00 27.54 C ATOM 800 CG ASN A 463 10.652 -1.254 -24.261 1.00 40.75 C ATOM 801 OD1 ASN A 463 10.949 -2.377 -24.680 1.00 35.25 O ATOM 802 ND2 ASN A 463 10.034 -1.084 -23.098 1.00 26.45 N ATOM 0 H ASN A 463 12.028 1.732 -23.110 1.00 30.28 H new ATOM 0 HA ASN A 463 13.038 -0.160 -24.790 1.00 29.71 H new ATOM 0 HB2 ASN A 463 10.347 0.674 -24.880 1.00 27.54 H new ATOM 0 HB3 ASN A 463 11.016 -0.205 -25.981 1.00 27.54 H new ATOM 0 HD21 ASN A 463 9.830 -1.766 -22.616 1.00 26.45 H new ATOM 0 HD22 ASN A 463 9.837 -0.292 -22.827 1.00 26.45 H new ATOM 803 N ARG A 464 14.094 2.100 -25.409 1.00 33.18 N ATOM 804 CA ARG A 464 14.676 3.272 -26.068 1.00 34.76 C ATOM 805 C ARG A 464 14.841 3.173 -27.580 1.00 40.05 C ATOM 806 O ARG A 464 15.160 4.175 -28.223 1.00 40.57 O ATOM 807 CB ARG A 464 15.965 3.722 -25.355 1.00 37.19 C ATOM 808 CG ARG A 464 15.723 4.145 -23.904 1.00 50.79 C ATOM 809 CD ARG A 464 16.906 4.881 -23.308 1.00 66.93 C ATOM 810 NE ARG A 464 16.861 4.883 -21.843 1.00 80.19 N ATOM 811 CZ ARG A 464 16.271 5.818 -21.104 1.00 95.77 C ATOM 812 NH1 ARG A 464 16.281 5.730 -19.781 1.00 78.77 N ATOM 813 NH2 ARG A 464 15.660 6.847 -21.683 1.00 86.58 N ATOM 0 H ARG A 464 14.667 1.649 -24.953 1.00 33.18 H new ATOM 0 HA ARG A 464 14.009 3.969 -25.971 1.00 34.76 H new ATOM 0 HB2 ARG A 464 16.610 2.997 -25.373 1.00 37.19 H new ATOM 0 HB3 ARG A 464 16.358 4.463 -25.842 1.00 37.19 H new ATOM 0 HG2 ARG A 464 14.938 4.714 -23.863 1.00 50.79 H new ATOM 0 HG3 ARG A 464 15.532 3.359 -23.369 1.00 50.79 H new ATOM 0 HD2 ARG A 464 17.730 4.465 -23.606 1.00 66.93 H new ATOM 0 HD3 ARG A 464 16.916 5.795 -23.633 1.00 66.93 H new ATOM 0 HE ARG A 464 17.244 4.232 -21.431 1.00 80.19 H new ATOM 0 HH11 ARG A 464 16.670 5.066 -19.397 1.00 78.77 H new ATOM 0 HH12 ARG A 464 15.898 6.337 -19.307 1.00 78.77 H new ATOM 0 HH21 ARG A 464 15.645 6.911 -22.540 1.00 86.58 H new ATOM 0 HH22 ARG A 464 15.280 7.449 -21.200 1.00 86.58 H new ATOM 814 N HIS A 465 14.569 1.995 -28.152 1.00 38.52 N ATOM 815 CA HIS A 465 14.659 1.766 -29.597 1.00 39.32 C ATOM 816 C HIS A 465 13.300 1.793 -30.327 1.00 38.82 C ATOM 817 O HIS A 465 13.231 1.447 -31.507 1.00 38.12 O ATOM 818 CB HIS A 465 15.522 0.525 -29.919 1.00 41.93 C ATOM 819 CG HIS A 465 16.862 0.556 -29.240 1.00 46.87 C ATOM 820 ND1 HIS A 465 17.767 1.583 -29.471 1.00 49.50 N ATOM 821 CD2 HIS A 465 17.380 -0.280 -28.310 1.00 49.84 C ATOM 822 CE1 HIS A 465 18.807 1.329 -28.691 1.00 49.49 C ATOM 823 NE2 HIS A 465 18.623 0.217 -27.975 1.00 49.87 N ATOM 0 H HIS A 465 14.325 1.301 -27.707 1.00 38.52 H new ATOM 0 HA HIS A 465 15.126 2.531 -29.967 1.00 39.32 H new ATOM 0 HB2 HIS A 465 15.045 -0.275 -29.648 1.00 41.93 H new ATOM 0 HB3 HIS A 465 15.651 0.466 -30.879 1.00 41.93 H new ATOM 0 HD2 HIS A 465 16.976 -1.043 -27.963 1.00 49.84 H new ATOM 0 HE1 HIS A 465 19.570 1.859 -28.647 1.00 49.49 H new ATOM 0 HE2 HIS A 465 19.175 -0.125 -27.411 1.00 49.87 H new ATOM 824 N VAL A 466 12.226 2.250 -29.635 1.00 32.56 N ATOM 825 CA VAL A 466 10.892 2.444 -30.227 1.00 30.44 C ATOM 826 C VAL A 466 11.027 3.540 -31.319 1.00 33.87 C ATOM 827 O VAL A 466 11.667 4.563 -31.092 1.00 34.17 O ATOM 828 CB VAL A 466 9.813 2.768 -29.146 1.00 33.27 C ATOM 829 CG1 VAL A 466 8.534 3.292 -29.778 1.00 32.30 C ATOM 830 CG2 VAL A 466 9.512 1.537 -28.279 1.00 33.02 C ATOM 0 H VAL A 466 12.262 2.455 -28.801 1.00 32.56 H new ATOM 0 HA VAL A 466 10.575 1.624 -30.638 1.00 30.44 H new ATOM 0 HB VAL A 466 10.176 3.464 -28.576 1.00 33.27 H new ATOM 0 HG11 VAL A 466 7.885 3.484 -29.083 1.00 32.30 H new ATOM 0 HG12 VAL A 466 8.726 4.104 -30.273 1.00 32.30 H new ATOM 0 HG13 VAL A 466 8.174 2.623 -30.381 1.00 32.30 H new ATOM 0 HG21 VAL A 466 8.840 1.764 -27.617 1.00 33.02 H new ATOM 0 HG22 VAL A 466 9.182 0.818 -28.841 1.00 33.02 H new ATOM 0 HG23 VAL A 466 10.323 1.250 -27.831 1.00 33.02 H new ATOM 831 N LYS A 467 10.487 3.286 -32.511 1.00 31.10 N ATOM 832 CA LYS A 467 10.600 4.174 -33.668 1.00 30.75 C ATOM 833 C LYS A 467 9.714 5.404 -33.556 1.00 34.05 C ATOM 834 O LYS A 467 8.674 5.340 -32.901 1.00 31.33 O ATOM 835 CB LYS A 467 10.300 3.394 -34.962 1.00 34.05 C ATOM 836 CG LYS A 467 11.329 2.306 -35.256 1.00 49.99 C ATOM 837 CD LYS A 467 10.836 1.290 -36.258 1.00 63.48 C ATOM 838 CE LYS A 467 11.749 0.084 -36.301 1.00 76.83 C ATOM 839 NZ LYS A 467 11.292 -0.922 -37.296 1.00 87.42 N ATOM 0 H LYS A 467 10.033 2.574 -32.673 1.00 31.10 H new ATOM 0 HA LYS A 467 11.514 4.499 -33.694 1.00 30.75 H new ATOM 0 HB2 LYS A 467 9.421 2.990 -34.894 1.00 34.05 H new ATOM 0 HB3 LYS A 467 10.270 4.014 -35.708 1.00 34.05 H new ATOM 0 HG2 LYS A 467 12.141 2.717 -35.591 1.00 49.99 H new ATOM 0 HG3 LYS A 467 11.560 1.853 -34.430 1.00 49.99 H new ATOM 0 HD2 LYS A 467 9.937 1.011 -36.025 1.00 63.48 H new ATOM 0 HD3 LYS A 467 10.788 1.695 -37.138 1.00 63.48 H new ATOM 0 HE2 LYS A 467 12.650 0.369 -36.520 1.00 76.83 H new ATOM 0 HE3 LYS A 467 11.786 -0.325 -35.422 1.00 76.83 H new ATOM 0 HZ1 LYS A 467 11.850 -1.616 -37.295 1.00 87.42 H new ATOM 0 HZ2 LYS A 467 10.474 -1.200 -37.083 1.00 87.42 H new ATOM 0 HZ3 LYS A 467 11.279 -0.554 -38.106 1.00 87.42 H new ATOM 840 N ASP A 468 10.105 6.521 -34.222 1.00 31.75 N ATOM 841 CA ASP A 468 9.317 7.766 -34.205 1.00 32.15 C ATOM 842 C ASP A 468 7.913 7.560 -34.781 1.00 31.55 C ATOM 843 O ASP A 468 6.956 8.121 -34.254 1.00 29.86 O ATOM 844 CB ASP A 468 10.064 8.968 -34.851 1.00 35.54 C ATOM 845 CG ASP A 468 10.524 8.789 -36.288 1.00 59.57 C ATOM 846 OD1 ASP A 468 10.107 7.791 -36.935 1.00 61.59 O ATOM 847 OD2 ASP A 468 11.293 9.651 -36.775 1.00 70.96 O1- ATOM 0 H ASP A 468 10.826 6.569 -34.688 1.00 31.75 H new ATOM 0 HA ASP A 468 9.203 8.006 -33.272 1.00 32.15 H new ATOM 0 HB2 ASP A 468 9.482 9.743 -34.813 1.00 35.54 H new ATOM 0 HB3 ASP A 468 10.841 9.170 -34.307 1.00 35.54 H new ATOM 848 N LYS A 469 7.784 6.675 -35.801 1.00 27.33 N ATOM 849 CA LYS A 469 6.510 6.301 -36.429 1.00 26.19 C ATOM 850 C LYS A 469 5.550 5.680 -35.371 1.00 28.77 C ATOM 851 O LYS A 469 4.366 6.019 -35.352 1.00 26.87 O ATOM 852 CB LYS A 469 6.765 5.307 -37.580 1.00 29.44 C ATOM 853 CG LYS A 469 5.511 4.777 -38.272 1.00 49.03 C ATOM 854 CD LYS A 469 5.834 3.565 -39.141 1.00 62.41 C ATOM 855 CE LYS A 469 4.591 2.828 -39.576 1.00 72.56 C ATOM 856 NZ LYS A 469 4.923 1.524 -40.203 1.00 78.92 N ATOM 0 H LYS A 469 8.460 6.271 -36.148 1.00 27.33 H new ATOM 0 HA LYS A 469 6.090 7.096 -36.792 1.00 26.19 H new ATOM 0 HB2 LYS A 469 7.325 5.740 -38.244 1.00 29.44 H new ATOM 0 HB3 LYS A 469 7.268 4.554 -37.232 1.00 29.44 H new ATOM 0 HG2 LYS A 469 4.849 4.534 -37.606 1.00 49.03 H new ATOM 0 HG3 LYS A 469 5.120 5.476 -38.819 1.00 49.03 H new ATOM 0 HD2 LYS A 469 6.328 3.853 -39.924 1.00 62.41 H new ATOM 0 HD3 LYS A 469 6.411 2.960 -38.648 1.00 62.41 H new ATOM 0 HE2 LYS A 469 4.015 2.682 -38.809 1.00 72.56 H new ATOM 0 HE3 LYS A 469 4.093 3.374 -40.205 1.00 72.56 H new ATOM 0 HZ1 LYS A 469 4.173 1.113 -40.449 1.00 78.92 H new ATOM 0 HZ2 LYS A 469 5.434 1.660 -40.919 1.00 78.92 H new ATOM 0 HZ3 LYS A 469 5.361 1.016 -39.618 1.00 78.92 H new ATOM 857 N ASN A 470 6.091 4.815 -34.485 1.00 25.08 N ATOM 858 CA ASN A 470 5.354 4.144 -33.401 1.00 24.68 C ATOM 859 C ASN A 470 4.945 5.153 -32.313 1.00 26.39 C ATOM 860 O ASN A 470 3.851 5.033 -31.752 1.00 24.17 O ATOM 861 CB ASN A 470 6.213 3.012 -32.812 1.00 24.34 C ATOM 862 CG ASN A 470 5.514 1.982 -31.940 1.00 36.23 C ATOM 863 OD1 ASN A 470 6.108 0.967 -31.602 1.00 29.88 O ATOM 864 ND2 ASN A 470 4.258 2.195 -31.539 1.00 25.82 N ATOM 0 H ASN A 470 6.924 4.600 -34.504 1.00 25.08 H new ATOM 0 HA ASN A 470 4.541 3.759 -33.764 1.00 24.68 H new ATOM 0 HB2 ASN A 470 6.636 2.543 -33.548 1.00 24.34 H new ATOM 0 HB3 ASN A 470 6.922 3.416 -32.288 1.00 24.34 H new ATOM 0 HD21 ASN A 470 3.862 1.617 -31.040 1.00 25.82 H new ATOM 0 HD22 ASN A 470 3.845 2.910 -31.780 1.00 25.82 H new ATOM 865 N ILE A 471 5.806 6.149 -32.022 1.00 23.48 N ATOM 866 CA ILE A 471 5.465 7.194 -31.041 1.00 22.63 C ATOM 867 C ILE A 471 4.319 8.064 -31.579 1.00 24.54 C ATOM 868 O ILE A 471 3.371 8.359 -30.842 1.00 22.38 O ATOM 869 CB ILE A 471 6.707 8.015 -30.586 1.00 25.95 C ATOM 870 CG1 ILE A 471 7.716 7.095 -29.861 1.00 25.70 C ATOM 871 CG2 ILE A 471 6.275 9.196 -29.665 1.00 25.58 C ATOM 872 CD1 ILE A 471 9.150 7.692 -29.736 1.00 28.70 C ATOM 0 H ILE A 471 6.584 6.234 -32.379 1.00 23.48 H new ATOM 0 HA ILE A 471 5.148 6.764 -30.231 1.00 22.63 H new ATOM 0 HB ILE A 471 7.139 8.388 -31.371 1.00 25.95 H new ATOM 0 HG12 ILE A 471 7.379 6.900 -28.972 1.00 25.70 H new ATOM 0 HG13 ILE A 471 7.768 6.251 -30.336 1.00 25.70 H new ATOM 0 HG21 ILE A 471 7.059 9.696 -29.391 1.00 25.58 H new ATOM 0 HG22 ILE A 471 5.672 9.781 -30.150 1.00 25.58 H new ATOM 0 HG23 ILE A 471 5.824 8.847 -28.880 1.00 25.58 H new ATOM 0 HD11 ILE A 471 9.724 7.062 -29.273 1.00 28.70 H new ATOM 0 HD12 ILE A 471 9.507 7.864 -30.621 1.00 28.70 H new ATOM 0 HD13 ILE A 471 9.113 8.522 -29.236 1.00 28.70 H new ATOM 873 N ILE A 472 4.392 8.457 -32.862 1.00 21.13 N ATOM 874 CA ILE A 472 3.344 9.257 -33.512 1.00 22.02 C ATOM 875 C ILE A 472 2.007 8.509 -33.441 1.00 25.07 C ATOM 876 O ILE A 472 0.988 9.124 -33.149 1.00 25.29 O ATOM 877 CB ILE A 472 3.712 9.652 -34.984 1.00 25.31 C ATOM 878 CG1 ILE A 472 4.954 10.571 -35.005 1.00 26.03 C ATOM 879 CG2 ILE A 472 2.511 10.326 -35.717 1.00 24.98 C ATOM 880 CD1 ILE A 472 5.824 10.521 -36.303 1.00 34.48 C ATOM 0 H ILE A 472 5.053 8.265 -33.378 1.00 21.13 H new ATOM 0 HA ILE A 472 3.263 10.094 -33.029 1.00 22.02 H new ATOM 0 HB ILE A 472 3.923 8.836 -35.464 1.00 25.31 H new ATOM 0 HG12 ILE A 472 4.660 11.485 -34.870 1.00 26.03 H new ATOM 0 HG13 ILE A 472 5.518 10.340 -34.250 1.00 26.03 H new ATOM 0 HG21 ILE A 472 2.772 10.557 -36.622 1.00 24.98 H new ATOM 0 HG22 ILE A 472 1.762 9.711 -35.744 1.00 24.98 H new ATOM 0 HG23 ILE A 472 2.251 11.130 -35.241 1.00 24.98 H new ATOM 0 HD11 ILE A 472 6.573 11.130 -36.214 1.00 34.48 H new ATOM 0 HD12 ILE A 472 6.155 9.619 -36.436 1.00 34.48 H new ATOM 0 HD13 ILE A 472 5.284 10.782 -37.065 1.00 34.48 H new ATOM 881 N GLU A 473 2.024 7.200 -33.716 1.00 22.09 N ATOM 882 CA GLU A 473 0.846 6.330 -33.676 1.00 22.25 C ATOM 883 C GLU A 473 0.171 6.407 -32.295 1.00 25.04 C ATOM 884 O GLU A 473 -1.043 6.609 -32.208 1.00 24.35 O ATOM 885 CB GLU A 473 1.286 4.884 -33.965 1.00 23.40 C ATOM 886 CG GLU A 473 0.142 3.886 -33.926 1.00 30.75 C ATOM 887 CD GLU A 473 0.555 2.434 -34.056 1.00 42.30 C ATOM 888 OE1 GLU A 473 1.705 2.102 -33.689 1.00 34.96 O ATOM 889 OE2 GLU A 473 -0.287 1.623 -34.500 1.00 37.33 O1- ATOM 0 H GLU A 473 2.743 6.784 -33.937 1.00 22.09 H new ATOM 0 HA GLU A 473 0.207 6.620 -34.345 1.00 22.25 H new ATOM 0 HB2 GLU A 473 1.707 4.850 -34.838 1.00 23.40 H new ATOM 0 HB3 GLU A 473 1.958 4.622 -33.316 1.00 23.40 H new ATOM 0 HG2 GLU A 473 -0.339 3.998 -33.091 1.00 30.75 H new ATOM 0 HG3 GLU A 473 -0.478 4.097 -34.641 1.00 30.75 H new ATOM 890 N LEU A 474 0.972 6.243 -31.229 1.00 21.12 N ATOM 891 CA LEU A 474 0.479 6.261 -29.845 1.00 20.71 C ATOM 892 C LEU A 474 -0.066 7.628 -29.410 1.00 25.08 C ATOM 893 O LEU A 474 -1.145 7.675 -28.801 1.00 22.99 O ATOM 894 CB LEU A 474 1.554 5.760 -28.879 1.00 20.88 C ATOM 895 CG LEU A 474 2.051 4.289 -29.085 1.00 24.02 C ATOM 896 CD1 LEU A 474 3.312 4.015 -28.270 1.00 23.85 C ATOM 897 CD2 LEU A 474 0.975 3.273 -28.758 1.00 24.16 C ATOM 0 H LEU A 474 1.820 6.118 -31.292 1.00 21.12 H new ATOM 0 HA LEU A 474 -0.276 5.652 -29.815 1.00 20.71 H new ATOM 0 HB2 LEU A 474 2.320 6.351 -28.945 1.00 20.88 H new ATOM 0 HB3 LEU A 474 1.211 5.840 -27.975 1.00 20.88 H new ATOM 0 HG LEU A 474 2.266 4.194 -30.026 1.00 24.02 H new ATOM 0 HD11 LEU A 474 3.599 3.100 -28.415 1.00 23.85 H new ATOM 0 HD12 LEU A 474 4.016 4.622 -28.549 1.00 23.85 H new ATOM 0 HD13 LEU A 474 3.124 4.149 -27.328 1.00 23.85 H new ATOM 0 HD21 LEU A 474 1.322 2.378 -28.898 1.00 24.16 H new ATOM 0 HD22 LEU A 474 0.705 3.374 -27.832 1.00 24.16 H new ATOM 0 HD23 LEU A 474 0.208 3.416 -29.335 1.00 24.16 H new ATOM 898 N VAL A 475 0.665 8.744 -29.708 1.00 22.24 N ATOM 899 CA VAL A 475 0.185 10.097 -29.357 1.00 22.27 C ATOM 900 C VAL A 475 -1.080 10.470 -30.163 1.00 24.20 C ATOM 901 O VAL A 475 -1.952 11.181 -29.653 1.00 20.53 O ATOM 902 CB VAL A 475 1.259 11.228 -29.310 1.00 25.61 C ATOM 903 CG1 VAL A 475 2.334 10.926 -28.262 1.00 25.62 C ATOM 904 CG2 VAL A 475 1.896 11.463 -30.678 1.00 25.29 C ATOM 0 H VAL A 475 1.427 8.728 -30.106 1.00 22.24 H new ATOM 0 HA VAL A 475 -0.065 10.032 -28.422 1.00 22.27 H new ATOM 0 HB VAL A 475 0.801 12.044 -29.053 1.00 25.61 H new ATOM 0 HG11 VAL A 475 2.988 11.643 -28.253 1.00 25.62 H new ATOM 0 HG12 VAL A 475 1.922 10.854 -27.387 1.00 25.62 H new ATOM 0 HG13 VAL A 475 2.774 10.090 -28.481 1.00 25.62 H new ATOM 0 HG21 VAL A 475 2.556 12.170 -30.611 1.00 25.29 H new ATOM 0 HG22 VAL A 475 2.326 10.647 -30.979 1.00 25.29 H new ATOM 0 HG23 VAL A 475 1.211 11.721 -31.314 1.00 25.29 H new ATOM 905 N HIS A 476 -1.198 9.954 -31.399 1.00 22.64 N ATOM 906 CA HIS A 476 -2.416 10.203 -32.179 1.00 23.93 C ATOM 907 C HIS A 476 -3.627 9.478 -31.543 1.00 26.25 C ATOM 908 O HIS A 476 -4.719 10.043 -31.513 1.00 27.14 O ATOM 909 CB HIS A 476 -2.248 9.822 -33.668 1.00 24.96 C ATOM 910 CG HIS A 476 -3.520 9.925 -34.449 1.00 28.39 C ATOM 911 ND1 HIS A 476 -4.043 8.834 -35.109 1.00 30.25 N ATOM 912 CD2 HIS A 476 -4.369 10.968 -34.593 1.00 30.24 C ATOM 913 CE1 HIS A 476 -5.172 9.248 -35.654 1.00 29.11 C ATOM 914 NE2 HIS A 476 -5.417 10.520 -35.362 1.00 29.59 N ATOM 0 H HIS A 476 -0.603 9.473 -31.791 1.00 22.64 H new ATOM 0 HA HIS A 476 -2.585 11.158 -32.157 1.00 23.93 H new ATOM 0 HB2 HIS A 476 -1.580 10.399 -34.070 1.00 24.96 H new ATOM 0 HB3 HIS A 476 -1.911 8.914 -33.728 1.00 24.96 H new ATOM 0 HD2 HIS A 476 -4.264 11.822 -34.240 1.00 30.24 H new ATOM 0 HE1 HIS A 476 -5.726 8.715 -36.177 1.00 29.11 H new ATOM 0 HE2 HIS A 476 -6.102 10.978 -35.608 1.00 29.59 H new ATOM 915 N GLN A 477 -3.420 8.267 -31.001 1.00 22.10 N ATOM 916 CA GLN A 477 -4.466 7.494 -30.315 1.00 21.67 C ATOM 917 C GLN A 477 -4.958 8.279 -29.091 1.00 24.48 C ATOM 918 O GLN A 477 -6.169 8.405 -28.892 1.00 24.97 O ATOM 919 CB GLN A 477 -3.967 6.093 -29.918 1.00 22.43 C ATOM 920 CG GLN A 477 -3.933 5.108 -31.108 1.00 25.08 C ATOM 921 CD GLN A 477 -3.201 3.835 -30.813 1.00 30.04 C ATOM 922 OE1 GLN A 477 -2.590 3.660 -29.761 1.00 27.21 O ATOM 923 NE2 GLN A 477 -3.185 2.933 -31.770 1.00 28.90 N ATOM 0 H GLN A 477 -2.658 7.869 -31.023 1.00 22.10 H new ATOM 0 HA GLN A 477 -5.208 7.362 -30.926 1.00 21.67 H new ATOM 0 HB2 GLN A 477 -3.077 6.167 -29.540 1.00 22.43 H new ATOM 0 HB3 GLN A 477 -4.542 5.735 -29.224 1.00 22.43 H new ATOM 0 HG2 GLN A 477 -4.843 4.896 -31.368 1.00 25.08 H new ATOM 0 HG3 GLN A 477 -3.515 5.544 -31.867 1.00 25.08 H new ATOM 0 HE21 GLN A 477 -3.618 3.072 -32.500 1.00 28.90 H new ATOM 0 HE22 GLN A 477 -2.741 2.204 -31.666 1.00 28.90 H new ATOM 924 N VAL A 478 -4.024 8.883 -28.338 1.00 21.24 N ATOM 925 CA VAL A 478 -4.338 9.749 -27.175 1.00 20.18 C ATOM 926 C VAL A 478 -5.173 10.970 -27.652 1.00 21.83 C ATOM 927 O VAL A 478 -6.184 11.319 -27.022 1.00 20.06 O ATOM 928 CB VAL A 478 -3.052 10.186 -26.420 1.00 23.01 C ATOM 929 CG1 VAL A 478 -3.359 11.220 -25.307 1.00 21.77 C ATOM 930 CG2 VAL A 478 -2.303 8.981 -25.866 1.00 22.63 C ATOM 0 H VAL A 478 -3.181 8.803 -28.487 1.00 21.24 H new ATOM 0 HA VAL A 478 -4.866 9.241 -26.539 1.00 20.18 H new ATOM 0 HB VAL A 478 -2.475 10.624 -27.065 1.00 23.01 H new ATOM 0 HG11 VAL A 478 -2.535 11.468 -24.859 1.00 21.77 H new ATOM 0 HG12 VAL A 478 -3.763 12.009 -25.701 1.00 21.77 H new ATOM 0 HG13 VAL A 478 -3.971 10.831 -24.663 1.00 21.77 H new ATOM 0 HG21 VAL A 478 -1.506 9.281 -25.401 1.00 22.63 H new ATOM 0 HG22 VAL A 478 -2.876 8.500 -25.249 1.00 22.63 H new ATOM 0 HG23 VAL A 478 -2.049 8.394 -26.595 1.00 22.63 H new ATOM 931 N SER A 479 -4.785 11.584 -28.791 1.00 20.79 N ATOM 932 CA SER A 479 -5.567 12.711 -29.335 1.00 20.78 C ATOM 933 C SER A 479 -7.002 12.301 -29.729 1.00 24.60 C ATOM 934 O SER A 479 -7.923 13.112 -29.577 1.00 24.70 O ATOM 935 CB SER A 479 -4.850 13.398 -30.494 1.00 22.98 C ATOM 936 OG SER A 479 -4.902 12.655 -31.702 1.00 25.96 O ATOM 0 H SER A 479 -4.091 11.368 -29.250 1.00 20.79 H new ATOM 0 HA SER A 479 -5.645 13.356 -28.615 1.00 20.78 H new ATOM 0 HB2 SER A 479 -5.247 14.271 -30.641 1.00 22.98 H new ATOM 0 HB3 SER A 479 -3.922 13.545 -30.251 1.00 22.98 H new ATOM 0 HG SER A 479 -4.726 11.849 -31.543 1.00 25.96 H new ATOM 937 N MET A 480 -7.196 11.060 -30.223 1.00 22.56 N ATOM 938 CA MET A 480 -8.538 10.550 -30.568 1.00 23.28 C ATOM 939 C MET A 480 -9.381 10.400 -29.274 1.00 25.93 C ATOM 940 O MET A 480 -10.539 10.818 -29.241 1.00 24.17 O ATOM 941 CB MET A 480 -8.467 9.229 -31.361 1.00 25.82 C ATOM 942 CG MET A 480 -7.955 9.413 -32.784 1.00 29.49 C ATOM 943 SD MET A 480 -8.125 7.932 -33.834 1.00 33.53 S ATOM 944 CE MET A 480 -6.758 6.968 -33.272 1.00 29.75 C ATOM 0 H MET A 480 -6.560 10.499 -30.365 1.00 22.56 H new ATOM 0 HA MET A 480 -8.972 11.191 -31.152 1.00 23.28 H new ATOM 0 HB2 MET A 480 -7.888 8.608 -30.893 1.00 25.82 H new ATOM 0 HB3 MET A 480 -9.350 8.828 -31.390 1.00 25.82 H new ATOM 0 HG2 MET A 480 -8.435 10.148 -33.198 1.00 29.49 H new ATOM 0 HG3 MET A 480 -7.020 9.668 -32.750 1.00 29.49 H new ATOM 0 HE1 MET A 480 -6.614 6.226 -33.880 1.00 29.75 H new ATOM 0 HE2 MET A 480 -5.962 7.521 -33.243 1.00 29.75 H new ATOM 0 HE3 MET A 480 -6.946 6.626 -32.384 1.00 29.75 H new ATOM 945 N GLY A 481 -8.769 9.874 -28.209 1.00 22.77 N ATOM 946 CA GLY A 481 -9.438 9.779 -26.907 1.00 22.25 C ATOM 947 C GLY A 481 -9.810 11.148 -26.354 1.00 24.01 C ATOM 948 O GLY A 481 -10.921 11.345 -25.841 1.00 23.60 O ATOM 0 H GLY A 481 -7.966 9.566 -28.220 1.00 22.77 H new ATOM 0 HA2 GLY A 481 -10.239 9.238 -26.995 1.00 22.25 H new ATOM 0 HA3 GLY A 481 -8.856 9.324 -26.278 1.00 22.25 H new ATOM 949 N MET A 482 -8.873 12.118 -26.448 1.00 20.67 N ATOM 950 CA MET A 482 -9.098 13.486 -25.977 1.00 19.47 C ATOM 951 C MET A 482 -10.127 14.236 -26.822 1.00 23.91 C ATOM 952 O MET A 482 -10.915 15.001 -26.267 1.00 22.20 O ATOM 953 CB MET A 482 -7.793 14.270 -25.814 1.00 20.37 C ATOM 954 CG MET A 482 -6.889 13.741 -24.705 1.00 21.79 C ATOM 955 SD MET A 482 -7.654 13.636 -23.053 1.00 23.70 S ATOM 956 CE MET A 482 -8.145 15.378 -22.798 1.00 19.94 C ATOM 0 H MET A 482 -8.093 11.991 -26.788 1.00 20.67 H new ATOM 0 HA MET A 482 -9.482 13.407 -25.090 1.00 19.47 H new ATOM 0 HB2 MET A 482 -7.307 14.250 -26.653 1.00 20.37 H new ATOM 0 HB3 MET A 482 -8.005 15.199 -25.631 1.00 20.37 H new ATOM 0 HG2 MET A 482 -6.577 12.858 -24.957 1.00 21.79 H new ATOM 0 HG3 MET A 482 -6.107 14.312 -24.647 1.00 21.79 H new ATOM 0 HE1 MET A 482 -8.309 15.533 -21.855 1.00 19.94 H new ATOM 0 HE2 MET A 482 -7.434 15.963 -23.103 1.00 19.94 H new ATOM 0 HE3 MET A 482 -8.953 15.563 -23.301 1.00 19.94 H new ATOM 957 N LYS A 483 -10.170 13.967 -28.151 1.00 22.13 N ATOM 958 CA LYS A 483 -11.212 14.541 -29.028 1.00 21.99 C ATOM 959 C LYS A 483 -12.618 14.119 -28.511 1.00 26.36 C ATOM 960 O LYS A 483 -13.528 14.947 -28.437 1.00 26.13 O ATOM 961 CB LYS A 483 -10.999 14.078 -30.471 1.00 24.70 C ATOM 962 CG LYS A 483 -11.912 14.757 -31.487 1.00 30.11 C ATOM 963 CD LYS A 483 -11.636 14.255 -32.881 1.00 34.65 C ATOM 964 CE LYS A 483 -12.696 14.767 -33.831 1.00 44.97 C ATOM 965 NZ LYS A 483 -12.546 14.150 -35.167 1.00 55.06 N ATOM 0 H LYS A 483 -9.607 13.458 -28.556 1.00 22.13 H new ATOM 0 HA LYS A 483 -11.152 15.509 -29.011 1.00 21.99 H new ATOM 0 HB2 LYS A 483 -10.076 14.243 -30.720 1.00 24.70 H new ATOM 0 HB3 LYS A 483 -11.138 13.119 -30.516 1.00 24.70 H new ATOM 0 HG2 LYS A 483 -12.839 14.589 -31.257 1.00 30.11 H new ATOM 0 HG3 LYS A 483 -11.781 15.718 -31.454 1.00 30.11 H new ATOM 0 HD2 LYS A 483 -10.759 14.551 -33.172 1.00 34.65 H new ATOM 0 HD3 LYS A 483 -11.625 13.285 -32.888 1.00 34.65 H new ATOM 0 HE2 LYS A 483 -13.577 14.570 -33.476 1.00 44.97 H new ATOM 0 HE3 LYS A 483 -12.630 15.732 -33.906 1.00 44.97 H new ATOM 0 HZ1 LYS A 483 -13.302 14.248 -35.626 1.00 55.06 H new ATOM 0 HZ2 LYS A 483 -11.880 14.547 -35.604 1.00 55.06 H new ATOM 0 HZ3 LYS A 483 -12.365 13.283 -35.075 1.00 55.06 H new ATOM 966 N TYR A 484 -12.757 12.848 -28.095 1.00 24.97 N ATOM 967 CA TYR A 484 -13.981 12.275 -27.543 1.00 24.70 C ATOM 968 C TYR A 484 -14.321 12.906 -26.183 1.00 27.83 C ATOM 969 O TYR A 484 -15.476 13.280 -25.983 1.00 26.45 O ATOM 970 CB TYR A 484 -13.876 10.736 -27.444 1.00 25.64 C ATOM 971 CG TYR A 484 -14.941 10.130 -26.560 1.00 26.51 C ATOM 972 CD1 TYR A 484 -16.221 9.877 -27.048 1.00 27.82 C ATOM 973 CD2 TYR A 484 -14.690 9.865 -25.215 1.00 26.04 C ATOM 974 CE1 TYR A 484 -17.214 9.345 -26.228 1.00 27.16 C ATOM 975 CE2 TYR A 484 -15.682 9.375 -24.381 1.00 26.22 C ATOM 976 CZ TYR A 484 -16.942 9.103 -24.895 1.00 32.39 C ATOM 977 OH TYR A 484 -17.908 8.566 -24.084 1.00 27.80 O ATOM 0 H TYR A 484 -12.111 12.281 -28.132 1.00 24.97 H new ATOM 0 HA TYR A 484 -14.710 12.480 -28.150 1.00 24.70 H new ATOM 0 HB2 TYR A 484 -13.944 10.354 -28.333 1.00 25.64 H new ATOM 0 HB3 TYR A 484 -13.001 10.498 -27.099 1.00 25.64 H new ATOM 0 HD1 TYR A 484 -16.416 10.067 -27.937 1.00 27.82 H new ATOM 0 HD2 TYR A 484 -13.840 10.020 -24.871 1.00 26.04 H new ATOM 0 HE1 TYR A 484 -18.055 9.154 -26.576 1.00 27.16 H new ATOM 0 HE2 TYR A 484 -15.504 9.229 -23.480 1.00 26.22 H new ATOM 0 HH TYR A 484 -18.416 8.076 -24.540 1.00 27.80 H new ATOM 978 N LEU A 485 -13.333 13.029 -25.252 1.00 24.77 N ATOM 979 CA LEU A 485 -13.587 13.670 -23.948 1.00 25.47 C ATOM 980 C LEU A 485 -14.070 15.116 -24.121 1.00 28.26 C ATOM 981 O LEU A 485 -14.969 15.544 -23.387 1.00 28.25 O ATOM 982 CB LEU A 485 -12.357 13.669 -23.033 1.00 26.64 C ATOM 983 CG LEU A 485 -12.051 12.420 -22.201 1.00 34.16 C ATOM 984 CD1 LEU A 485 -10.781 12.647 -21.357 1.00 35.49 C ATOM 985 CD2 LEU A 485 -13.191 12.083 -21.233 1.00 34.33 C ATOM 0 H LEU A 485 -12.527 12.750 -25.363 1.00 24.77 H new ATOM 0 HA LEU A 485 -14.280 13.137 -23.528 1.00 25.47 H new ATOM 0 HB2 LEU A 485 -11.581 13.850 -23.586 1.00 26.64 H new ATOM 0 HB3 LEU A 485 -12.448 14.415 -22.419 1.00 26.64 H new ATOM 0 HG LEU A 485 -11.933 11.688 -22.827 1.00 34.16 H new ATOM 0 HD11 LEU A 485 -10.594 11.852 -20.833 1.00 35.49 H new ATOM 0 HD12 LEU A 485 -10.031 12.831 -21.944 1.00 35.49 H new ATOM 0 HD13 LEU A 485 -10.918 13.401 -20.762 1.00 35.49 H new ATOM 0 HD21 LEU A 485 -12.961 11.289 -20.726 1.00 34.33 H new ATOM 0 HD22 LEU A 485 -13.330 12.826 -20.625 1.00 34.33 H new ATOM 0 HD23 LEU A 485 -14.005 11.921 -21.735 1.00 34.33 H new ATOM 986 N GLU A 486 -13.463 15.870 -25.082 1.00 23.70 N ATOM 987 CA GLU A 486 -13.832 17.255 -25.372 1.00 24.11 C ATOM 988 C GLU A 486 -15.293 17.301 -25.877 1.00 30.56 C ATOM 989 O GLU A 486 -16.074 18.124 -25.397 1.00 30.39 O ATOM 990 CB GLU A 486 -12.873 17.851 -26.428 1.00 25.70 C ATOM 991 CG GLU A 486 -13.214 19.262 -26.879 1.00 32.26 C ATOM 992 CD GLU A 486 -12.182 19.806 -27.845 1.00 47.94 C ATOM 993 OE1 GLU A 486 -12.265 19.457 -29.042 1.00 36.86 O ATOM 994 OE2 GLU A 486 -11.240 20.497 -27.394 1.00 42.11 O1- ATOM 0 H GLU A 486 -12.825 15.574 -25.576 1.00 23.70 H new ATOM 0 HA GLU A 486 -13.760 17.785 -24.563 1.00 24.11 H new ATOM 0 HB2 GLU A 486 -11.973 17.850 -26.066 1.00 25.70 H new ATOM 0 HB3 GLU A 486 -12.867 17.270 -27.205 1.00 25.70 H new ATOM 0 HG2 GLU A 486 -14.087 19.265 -27.302 1.00 32.26 H new ATOM 0 HG3 GLU A 486 -13.272 19.844 -26.105 1.00 32.26 H new ATOM 995 N GLU A 487 -15.643 16.419 -26.846 1.00 28.76 N ATOM 996 CA GLU A 487 -17.008 16.280 -27.396 1.00 29.23 C ATOM 997 C GLU A 487 -17.982 15.977 -26.248 1.00 30.55 C ATOM 998 O GLU A 487 -19.093 16.497 -26.240 1.00 30.43 O ATOM 999 CB GLU A 487 -17.066 15.113 -28.404 1.00 30.93 C ATOM 1000 CG GLU A 487 -16.531 15.434 -29.789 1.00 43.33 C ATOM 1001 CD GLU A 487 -16.302 14.264 -30.734 1.00 58.23 C ATOM 1002 OE1 GLU A 487 -16.554 13.103 -30.336 1.00 52.04 O ATOM 1003 OE2 GLU A 487 -15.841 14.513 -31.873 1.00 45.54 O1- ATOM 0 H GLU A 487 -15.079 15.878 -27.204 1.00 28.76 H new ATOM 0 HA GLU A 487 -17.250 17.106 -27.844 1.00 29.23 H new ATOM 0 HB2 GLU A 487 -16.563 14.366 -28.043 1.00 30.93 H new ATOM 0 HB3 GLU A 487 -17.987 14.821 -28.487 1.00 30.93 H new ATOM 0 HG2 GLU A 487 -17.149 16.048 -30.215 1.00 43.33 H new ATOM 0 HG3 GLU A 487 -15.690 15.905 -29.685 1.00 43.33 H new ATOM 1004 N SER A 488 -17.553 15.144 -25.278 1.00 25.11 N ATOM 1005 CA SER A 488 -18.356 14.740 -24.107 1.00 24.69 C ATOM 1006 C SER A 488 -18.439 15.797 -22.983 1.00 28.77 C ATOM 1007 O SER A 488 -19.184 15.597 -22.013 1.00 27.80 O ATOM 1008 CB SER A 488 -17.853 13.408 -23.556 1.00 26.22 C ATOM 1009 OG SER A 488 -17.814 12.438 -24.588 1.00 29.58 O ATOM 0 H SER A 488 -16.768 14.792 -25.286 1.00 25.11 H new ATOM 0 HA SER A 488 -19.264 14.646 -24.434 1.00 24.69 H new ATOM 0 HB2 SER A 488 -16.968 13.521 -23.175 1.00 26.22 H new ATOM 0 HB3 SER A 488 -18.434 13.106 -22.840 1.00 26.22 H new ATOM 0 HG SER A 488 -17.151 12.582 -25.083 1.00 29.58 H new ATOM 1010 N ASN A 489 -17.681 16.918 -23.106 1.00 26.36 N ATOM 1011 CA ASN A 489 -17.625 18.008 -22.106 1.00 25.66 C ATOM 1012 C ASN A 489 -17.096 17.615 -20.736 1.00 27.72 C ATOM 1013 O ASN A 489 -17.624 18.027 -19.693 1.00 27.15 O ATOM 1014 CB ASN A 489 -18.911 18.870 -22.059 1.00 28.70 C ATOM 1015 CG ASN A 489 -19.145 19.614 -23.364 1.00 45.45 C ATOM 1016 OD1 ASN A 489 -18.311 20.394 -23.833 1.00 39.91 O ATOM 1017 ND2 ASN A 489 -20.247 19.330 -24.018 1.00 36.88 N ATOM 0 H ASN A 489 -17.178 17.062 -23.789 1.00 26.36 H new ATOM 0 HA ASN A 489 -16.931 18.593 -22.448 1.00 25.66 H new ATOM 0 HB2 ASN A 489 -19.674 18.301 -21.870 1.00 28.70 H new ATOM 0 HB3 ASN A 489 -18.846 19.508 -21.331 1.00 28.70 H new ATOM 0 HD21 ASN A 489 -20.396 19.689 -24.785 1.00 36.88 H new ATOM 0 HD22 ASN A 489 -20.820 18.785 -23.680 1.00 36.88 H new ATOM 1018 N PHE A 490 -16.048 16.775 -20.741 1.00 22.78 N ATOM 1019 CA PHE A 490 -15.334 16.430 -19.528 1.00 22.66 C ATOM 1020 C PHE A 490 -13.927 17.017 -19.666 1.00 26.11 C ATOM 1021 O PHE A 490 -13.338 16.991 -20.757 1.00 25.24 O ATOM 1022 CB PHE A 490 -15.215 14.907 -19.336 1.00 24.57 C ATOM 1023 CG PHE A 490 -16.476 14.225 -18.879 1.00 25.46 C ATOM 1024 CD1 PHE A 490 -17.402 13.752 -19.802 1.00 29.53 C ATOM 1025 CD2 PHE A 490 -16.714 14.003 -17.531 1.00 27.20 C ATOM 1026 CE1 PHE A 490 -18.556 13.090 -19.379 1.00 30.30 C ATOM 1027 CE2 PHE A 490 -17.870 13.337 -17.108 1.00 30.30 C ATOM 1028 CZ PHE A 490 -18.784 12.891 -18.033 1.00 28.83 C ATOM 0 H PHE A 490 -15.742 16.397 -21.450 1.00 22.78 H new ATOM 0 HA PHE A 490 -15.815 16.781 -18.762 1.00 22.66 H new ATOM 0 HB2 PHE A 490 -14.934 14.510 -20.175 1.00 24.57 H new ATOM 0 HB3 PHE A 490 -14.514 14.730 -18.689 1.00 24.57 H new ATOM 0 HD1 PHE A 490 -17.251 13.878 -20.711 1.00 29.53 H new ATOM 0 HD2 PHE A 490 -16.098 14.300 -16.901 1.00 27.20 H new ATOM 0 HE1 PHE A 490 -19.171 12.783 -20.005 1.00 30.30 H new ATOM 0 HE2 PHE A 490 -18.020 13.196 -16.201 1.00 30.30 H new ATOM 0 HZ PHE A 490 -19.556 12.455 -17.751 1.00 28.83 H new ATOM 1029 N VAL A 491 -13.389 17.513 -18.565 1.00 21.62 N ATOM 1030 CA VAL A 491 -12.010 18.002 -18.508 1.00 21.70 C ATOM 1031 C VAL A 491 -11.195 16.943 -17.770 1.00 24.90 C ATOM 1032 O VAL A 491 -11.654 16.442 -16.738 1.00 22.87 O ATOM 1033 CB VAL A 491 -11.836 19.442 -17.944 1.00 26.11 C ATOM 1034 CG1 VAL A 491 -12.442 20.466 -18.900 1.00 26.79 C ATOM 1035 CG2 VAL A 491 -12.421 19.607 -16.537 1.00 25.68 C ATOM 0 H VAL A 491 -13.813 17.579 -17.820 1.00 21.62 H new ATOM 0 HA VAL A 491 -11.678 18.117 -19.412 1.00 21.70 H new ATOM 0 HB VAL A 491 -10.882 19.599 -17.868 1.00 26.11 H new ATOM 0 HG11 VAL A 491 -12.326 21.357 -18.536 1.00 26.79 H new ATOM 0 HG12 VAL A 491 -11.998 20.409 -19.760 1.00 26.79 H new ATOM 0 HG13 VAL A 491 -13.388 20.284 -19.013 1.00 26.79 H new ATOM 0 HG21 VAL A 491 -12.286 20.519 -16.235 1.00 25.68 H new ATOM 0 HG22 VAL A 491 -13.371 19.410 -16.556 1.00 25.68 H new ATOM 0 HG23 VAL A 491 -11.977 18.996 -15.928 1.00 25.68 H new ATOM 1036 N HIS A 492 -10.020 16.561 -18.308 1.00 20.42 N ATOM 1037 CA HIS A 492 -9.232 15.488 -17.668 1.00 19.93 C ATOM 1038 C HIS A 492 -8.481 15.988 -16.417 1.00 21.38 C ATOM 1039 O HIS A 492 -8.598 15.372 -15.358 1.00 21.57 O ATOM 1040 CB HIS A 492 -8.301 14.806 -18.681 1.00 19.75 C ATOM 1041 CG HIS A 492 -7.616 13.576 -18.162 1.00 22.27 C ATOM 1042 ND1 HIS A 492 -6.568 13.653 -17.258 1.00 23.31 N ATOM 1043 CD2 HIS A 492 -7.855 12.273 -18.440 1.00 23.29 C ATOM 1044 CE1 HIS A 492 -6.198 12.402 -17.024 1.00 22.51 C ATOM 1045 NE2 HIS A 492 -6.942 11.539 -17.708 1.00 23.07 N ATOM 0 H HIS A 492 -9.672 16.898 -19.019 1.00 20.42 H new ATOM 0 HA HIS A 492 -9.855 14.813 -17.354 1.00 19.93 H new ATOM 0 HB2 HIS A 492 -8.816 14.569 -19.468 1.00 19.75 H new ATOM 0 HB3 HIS A 492 -7.627 15.443 -18.964 1.00 19.75 H new ATOM 0 HD2 HIS A 492 -8.507 11.937 -19.012 1.00 23.29 H new ATOM 0 HE1 HIS A 492 -5.505 12.159 -16.453 1.00 22.51 H new ATOM 0 HE2 HIS A 492 -6.869 10.682 -17.697 1.00 23.07 H new ATOM 1046 N ARG A 493 -7.700 17.071 -16.556 1.00 18.14 N ATOM 1047 CA ARG A 493 -6.915 17.739 -15.479 1.00 18.95 C ATOM 1048 C ARG A 493 -5.695 16.987 -14.938 1.00 23.66 C ATOM 1049 O ARG A 493 -5.073 17.440 -13.976 1.00 24.82 O ATOM 1050 CB ARG A 493 -7.804 18.336 -14.350 1.00 16.52 C ATOM 1051 CG ARG A 493 -8.899 19.299 -14.831 1.00 27.29 C ATOM 1052 CD ARG A 493 -9.810 19.767 -13.686 1.00 28.49 C ATOM 1053 NE ARG A 493 -9.081 20.592 -12.718 1.00 30.29 N ATOM 1054 CZ ARG A 493 -8.992 20.358 -11.408 1.00 41.37 C ATOM 1055 NH1 ARG A 493 -9.606 19.311 -10.868 1.00 27.71 N ATOM 1056 NH2 ARG A 493 -8.304 21.179 -10.628 1.00 31.53 N ATOM 0 H ARG A 493 -7.604 17.461 -17.316 1.00 18.14 H new ATOM 0 HA ARG A 493 -6.512 18.482 -15.955 1.00 18.95 H new ATOM 0 HB2 ARG A 493 -8.222 17.607 -13.866 1.00 16.52 H new ATOM 0 HB3 ARG A 493 -7.234 18.804 -13.720 1.00 16.52 H new ATOM 0 HG2 ARG A 493 -8.487 20.071 -15.249 1.00 27.29 H new ATOM 0 HG3 ARG A 493 -9.436 18.861 -15.510 1.00 27.29 H new ATOM 0 HD2 ARG A 493 -10.553 20.274 -14.049 1.00 28.49 H new ATOM 0 HD3 ARG A 493 -10.187 18.995 -13.235 1.00 28.49 H new ATOM 0 HE ARG A 493 -8.676 21.287 -13.021 1.00 30.29 H new ATOM 0 HH11 ARG A 493 -10.065 18.779 -11.364 1.00 27.71 H new ATOM 0 HH12 ARG A 493 -9.545 19.166 -10.023 1.00 27.71 H new ATOM 0 HH21 ARG A 493 -7.913 21.866 -10.966 1.00 31.53 H new ATOM 0 HH22 ARG A 493 -8.249 21.025 -9.784 1.00 31.53 H new ATOM 1057 N ASP A 494 -5.319 15.865 -15.559 1.00 19.42 N ATOM 1058 CA ASP A 494 -4.073 15.163 -15.182 1.00 19.48 C ATOM 1059 C ASP A 494 -3.504 14.420 -16.399 1.00 22.24 C ATOM 1060 O ASP A 494 -3.103 13.262 -16.310 1.00 22.30 O ATOM 1061 CB ASP A 494 -4.300 14.209 -13.989 1.00 20.73 C ATOM 1062 CG ASP A 494 -3.045 13.876 -13.207 1.00 27.55 C ATOM 1063 OD1 ASP A 494 -1.986 14.478 -13.494 1.00 24.77 O ATOM 1064 OD2 ASP A 494 -3.113 12.986 -12.338 1.00 31.60 O1- ATOM 0 H ASP A 494 -5.762 15.493 -16.195 1.00 19.42 H new ATOM 0 HA ASP A 494 -3.423 15.822 -14.893 1.00 19.48 H new ATOM 0 HB2 ASP A 494 -4.946 14.610 -13.387 1.00 20.73 H new ATOM 0 HB3 ASP A 494 -4.691 13.385 -14.318 1.00 20.73 H new ATOM 1065 N LEU A 495 -3.520 15.080 -17.551 1.00 19.97 N ATOM 1066 CA LEU A 495 -3.088 14.443 -18.784 1.00 19.67 C ATOM 1067 C LEU A 495 -1.587 14.535 -18.868 1.00 23.66 C ATOM 1068 O LEU A 495 -1.036 15.612 -19.052 1.00 25.74 O ATOM 1069 CB LEU A 495 -3.791 15.070 -20.007 1.00 18.81 C ATOM 1070 CG LEU A 495 -3.480 14.451 -21.381 1.00 21.47 C ATOM 1071 CD1 LEU A 495 -3.875 12.980 -21.441 1.00 20.88 C ATOM 1072 CD2 LEU A 495 -4.152 15.270 -22.510 1.00 20.55 C ATOM 0 H LEU A 495 -3.777 15.896 -17.639 1.00 19.97 H new ATOM 0 HA LEU A 495 -3.340 13.506 -18.784 1.00 19.67 H new ATOM 0 HB2 LEU A 495 -4.749 15.020 -19.863 1.00 18.81 H new ATOM 0 HB3 LEU A 495 -3.558 16.011 -20.040 1.00 18.81 H new ATOM 0 HG LEU A 495 -2.520 14.487 -21.514 1.00 21.47 H new ATOM 0 HD11 LEU A 495 -3.665 12.624 -22.319 1.00 20.88 H new ATOM 0 HD12 LEU A 495 -3.384 12.485 -20.766 1.00 20.88 H new ATOM 0 HD13 LEU A 495 -4.827 12.893 -21.277 1.00 20.88 H new ATOM 0 HD21 LEU A 495 -3.947 14.867 -23.368 1.00 20.55 H new ATOM 0 HD22 LEU A 495 -5.113 15.276 -22.378 1.00 20.55 H new ATOM 0 HD23 LEU A 495 -3.818 16.181 -22.492 1.00 20.55 H new ATOM 1073 N ALA A 496 -0.937 13.391 -18.730 1.00 19.16 N ATOM 1074 CA ALA A 496 0.521 13.252 -18.677 1.00 18.64 C ATOM 1075 C ALA A 496 0.900 11.863 -19.169 1.00 21.86 C ATOM 1076 O ALA A 496 0.066 10.957 -19.123 1.00 21.04 O ATOM 1077 CB ALA A 496 0.994 13.413 -17.239 1.00 18.61 C ATOM 0 H ALA A 496 -1.346 12.638 -18.661 1.00 19.16 H new ATOM 0 HA ALA A 496 0.935 13.930 -19.234 1.00 18.64 H new ATOM 0 HB1 ALA A 496 1.959 13.321 -17.203 1.00 18.61 H new ATOM 0 HB2 ALA A 496 0.741 14.290 -16.911 1.00 18.61 H new ATOM 0 HB3 ALA A 496 0.584 12.731 -16.685 1.00 18.61 H new ATOM 1078 N ALA A 497 2.159 11.690 -19.629 1.00 19.88 N ATOM 1079 CA ALA A 497 2.659 10.400 -20.116 1.00 18.79 C ATOM 1080 C ALA A 497 2.470 9.249 -19.114 1.00 21.34 C ATOM 1081 O ALA A 497 2.186 8.149 -19.545 1.00 19.33 O ATOM 1082 CB ALA A 497 4.110 10.517 -20.558 1.00 19.18 C ATOM 0 H ALA A 497 2.740 12.323 -19.664 1.00 19.88 H new ATOM 0 HA ALA A 497 2.115 10.169 -20.885 1.00 18.79 H new ATOM 0 HB1 ALA A 497 4.422 9.655 -20.876 1.00 19.18 H new ATOM 0 HB2 ALA A 497 4.179 11.169 -21.272 1.00 19.18 H new ATOM 0 HB3 ALA A 497 4.655 10.801 -19.808 1.00 19.18 H new ATOM 1083 N ARG A 498 2.596 9.509 -17.786 1.00 18.65 N ATOM 1084 CA ARG A 498 2.388 8.526 -16.712 1.00 19.04 C ATOM 1085 C ARG A 498 0.946 7.996 -16.690 1.00 23.03 C ATOM 1086 O ARG A 498 0.707 6.901 -16.155 1.00 23.00 O ATOM 1087 CB ARG A 498 2.737 9.124 -15.307 1.00 17.03 C ATOM 1088 CG ARG A 498 1.781 10.250 -14.864 1.00 19.99 C ATOM 1089 CD ARG A 498 2.100 10.828 -13.478 1.00 23.02 C ATOM 1090 NE ARG A 498 1.365 12.082 -13.254 1.00 26.20 N ATOM 1091 CZ ARG A 498 1.750 13.268 -13.724 1.00 37.55 C ATOM 1092 NH1 ARG A 498 2.897 13.390 -14.379 1.00 26.70 N ATOM 1093 NH2 ARG A 498 1.014 14.347 -13.503 1.00 26.35 N ATOM 0 H ARG A 498 2.811 10.287 -17.489 1.00 18.65 H new ATOM 0 HA ARG A 498 2.989 7.788 -16.901 1.00 19.04 H new ATOM 0 HB2 ARG A 498 2.717 8.414 -14.647 1.00 17.03 H new ATOM 0 HB3 ARG A 498 3.644 9.468 -15.326 1.00 17.03 H new ATOM 0 HG2 ARG A 498 1.813 10.965 -15.518 1.00 19.99 H new ATOM 0 HG3 ARG A 498 0.873 9.909 -14.861 1.00 19.99 H new ATOM 0 HD2 ARG A 498 1.865 10.183 -12.792 1.00 23.02 H new ATOM 0 HD3 ARG A 498 3.054 10.989 -13.402 1.00 23.02 H new ATOM 0 HE ARG A 498 0.641 12.048 -12.791 1.00 26.20 H new ATOM 0 HH11 ARG A 498 3.397 12.701 -14.502 1.00 26.70 H new ATOM 0 HH12 ARG A 498 3.141 14.158 -14.680 1.00 26.70 H new ATOM 0 HH21 ARG A 498 0.283 14.284 -13.054 1.00 26.35 H new ATOM 0 HH22 ARG A 498 1.267 15.110 -13.809 1.00 26.35 H new ATOM 1094 N ASN A 499 -0.008 8.790 -17.232 1.00 19.83 N ATOM 1095 CA ASN A 499 -1.444 8.466 -17.284 1.00 20.32 C ATOM 1096 C ASN A 499 -1.934 7.937 -18.613 1.00 24.61 C ATOM 1097 O ASN A 499 -3.131 7.796 -18.815 1.00 27.44 O ATOM 1098 CB ASN A 499 -2.306 9.600 -16.731 1.00 22.13 C ATOM 1099 CG ASN A 499 -2.038 9.851 -15.274 1.00 32.63 C ATOM 1100 OD1 ASN A 499 -1.715 8.922 -14.522 1.00 21.45 O ATOM 1101 ND2 ASN A 499 -2.208 11.096 -14.838 1.00 23.90 N ATOM 0 H ASN A 499 0.176 9.551 -17.587 1.00 19.83 H new ATOM 0 HA ASN A 499 -1.551 7.708 -16.688 1.00 20.32 H new ATOM 0 HB2 ASN A 499 -2.135 10.411 -17.235 1.00 22.13 H new ATOM 0 HB3 ASN A 499 -3.243 9.382 -16.854 1.00 22.13 H new ATOM 0 HD21 ASN A 499 -2.093 11.280 -14.006 1.00 23.90 H new ATOM 0 HD22 ASN A 499 -2.433 11.717 -15.388 1.00 23.90 H new ATOM 1102 N VAL A 500 -1.005 7.632 -19.514 1.00 21.28 N ATOM 1103 CA VAL A 500 -1.295 6.952 -20.778 1.00 21.32 C ATOM 1104 C VAL A 500 -0.803 5.505 -20.529 1.00 24.64 C ATOM 1105 O VAL A 500 0.358 5.312 -20.175 1.00 23.51 O ATOM 1106 CB VAL A 500 -0.580 7.605 -21.978 1.00 24.75 C ATOM 1107 CG1 VAL A 500 -0.793 6.785 -23.245 1.00 24.40 C ATOM 1108 CG2 VAL A 500 -1.052 9.045 -22.173 1.00 24.67 C ATOM 0 H VAL A 500 -0.172 7.817 -19.408 1.00 21.28 H new ATOM 0 HA VAL A 500 -2.235 6.997 -21.014 1.00 21.32 H new ATOM 0 HB VAL A 500 0.371 7.625 -21.790 1.00 24.75 H new ATOM 0 HG11 VAL A 500 -0.336 7.211 -23.987 1.00 24.40 H new ATOM 0 HG12 VAL A 500 -0.437 5.892 -23.117 1.00 24.40 H new ATOM 0 HG13 VAL A 500 -1.742 6.729 -23.439 1.00 24.40 H new ATOM 0 HG21 VAL A 500 -0.591 9.437 -22.931 1.00 24.67 H new ATOM 0 HG22 VAL A 500 -2.008 9.053 -22.337 1.00 24.67 H new ATOM 0 HG23 VAL A 500 -0.857 9.561 -21.375 1.00 24.67 H new ATOM 1109 N LEU A 501 -1.698 4.513 -20.652 1.00 21.83 N ATOM 1110 CA LEU A 501 -1.395 3.090 -20.409 1.00 21.40 C ATOM 1111 C LEU A 501 -1.426 2.319 -21.703 1.00 24.42 C ATOM 1112 O LEU A 501 -2.287 2.566 -22.540 1.00 23.98 O ATOM 1113 CB LEU A 501 -2.393 2.471 -19.395 1.00 21.39 C ATOM 1114 CG LEU A 501 -2.465 3.151 -18.010 1.00 25.68 C ATOM 1115 CD1 LEU A 501 -3.523 2.504 -17.148 1.00 25.41 C ATOM 1116 CD2 LEU A 501 -1.115 3.103 -17.273 1.00 27.66 C ATOM 0 H LEU A 501 -2.515 4.651 -20.884 1.00 21.83 H new ATOM 0 HA LEU A 501 -0.504 3.035 -20.030 1.00 21.40 H new ATOM 0 HB2 LEU A 501 -3.279 2.488 -19.790 1.00 21.39 H new ATOM 0 HB3 LEU A 501 -2.158 1.539 -19.266 1.00 21.39 H new ATOM 0 HG LEU A 501 -2.696 4.080 -18.168 1.00 25.68 H new ATOM 0 HD11 LEU A 501 -3.552 2.945 -16.285 1.00 25.41 H new ATOM 0 HD12 LEU A 501 -4.387 2.585 -17.581 1.00 25.41 H new ATOM 0 HD13 LEU A 501 -3.311 1.566 -17.024 1.00 25.41 H new ATOM 0 HD21 LEU A 501 -1.201 3.539 -16.411 1.00 27.66 H new ATOM 0 HD22 LEU A 501 -0.850 2.179 -17.143 1.00 27.66 H new ATOM 0 HD23 LEU A 501 -0.442 3.561 -17.800 1.00 27.66 H new ATOM 1117 N LEU A 502 -0.498 1.374 -21.863 1.00 22.32 N ATOM 1118 CA LEU A 502 -0.386 0.601 -23.088 1.00 23.00 C ATOM 1119 C LEU A 502 -1.056 -0.764 -23.007 1.00 26.53 C ATOM 1120 O LEU A 502 -0.806 -1.520 -22.065 1.00 25.48 O ATOM 1121 CB LEU A 502 1.098 0.447 -23.499 1.00 23.94 C ATOM 1122 CG LEU A 502 1.837 1.731 -23.894 1.00 29.58 C ATOM 1123 CD1 LEU A 502 3.278 1.439 -24.199 1.00 30.18 C ATOM 1124 CD2 LEU A 502 1.196 2.374 -25.108 1.00 31.02 C ATOM 0 H LEU A 502 0.081 1.167 -21.262 1.00 22.32 H new ATOM 0 HA LEU A 502 -0.863 1.101 -23.769 1.00 23.00 H new ATOM 0 HB2 LEU A 502 1.576 0.037 -22.761 1.00 23.94 H new ATOM 0 HB3 LEU A 502 1.143 -0.171 -24.245 1.00 23.94 H new ATOM 0 HG LEU A 502 1.782 2.343 -23.143 1.00 29.58 H new ATOM 0 HD11 LEU A 502 3.730 2.261 -24.447 1.00 30.18 H new ATOM 0 HD12 LEU A 502 3.705 1.060 -23.415 1.00 30.18 H new ATOM 0 HD13 LEU A 502 3.332 0.807 -24.933 1.00 30.18 H new ATOM 0 HD21 LEU A 502 1.679 3.183 -25.339 1.00 31.02 H new ATOM 0 HD22 LEU A 502 1.225 1.756 -25.855 1.00 31.02 H new ATOM 0 HD23 LEU A 502 0.273 2.595 -24.908 1.00 31.02 H new ATOM 1125 N VAL A 503 -1.955 -1.048 -23.967 1.00 22.88 N ATOM 1126 CA VAL A 503 -2.612 -2.366 -24.088 1.00 23.82 C ATOM 1127 C VAL A 503 -1.566 -3.275 -24.795 1.00 28.61 C ATOM 1128 O VAL A 503 -1.283 -4.393 -24.345 1.00 27.94 O ATOM 1129 CB VAL A 503 -3.949 -2.273 -24.875 1.00 27.90 C ATOM 1130 CG1 VAL A 503 -4.551 -3.661 -25.129 1.00 27.88 C ATOM 1131 CG2 VAL A 503 -4.943 -1.387 -24.131 1.00 27.56 C ATOM 0 H VAL A 503 -2.201 -0.482 -24.566 1.00 22.88 H new ATOM 0 HA VAL A 503 -2.864 -2.727 -23.224 1.00 23.82 H new ATOM 0 HB VAL A 503 -3.758 -1.873 -25.738 1.00 27.90 H new ATOM 0 HG11 VAL A 503 -5.382 -3.568 -25.621 1.00 27.88 H new ATOM 0 HG12 VAL A 503 -3.928 -4.195 -25.646 1.00 27.88 H new ATOM 0 HG13 VAL A 503 -4.725 -4.099 -24.281 1.00 27.88 H new ATOM 0 HG21 VAL A 503 -5.772 -1.338 -24.633 1.00 27.56 H new ATOM 0 HG22 VAL A 503 -5.118 -1.763 -23.254 1.00 27.56 H new ATOM 0 HG23 VAL A 503 -4.572 -0.496 -24.032 1.00 27.56 H new ATOM 1132 N THR A 504 -0.982 -2.750 -25.894 1.00 25.20 N ATOM 1133 CA THR A 504 0.115 -3.363 -26.668 1.00 25.74 C ATOM 1134 C THR A 504 1.081 -2.218 -26.998 1.00 28.18 C ATOM 1135 O THR A 504 0.790 -1.064 -26.683 1.00 26.19 O ATOM 1136 CB THR A 504 -0.381 -4.019 -28.004 1.00 30.44 C ATOM 1137 OG1 THR A 504 -0.761 -3.003 -28.939 1.00 24.35 O ATOM 1138 CG2 THR A 504 -1.514 -5.013 -27.812 1.00 31.26 C ATOM 0 H THR A 504 -1.229 -1.993 -26.219 1.00 25.20 H new ATOM 0 HA THR A 504 0.525 -4.073 -26.150 1.00 25.74 H new ATOM 0 HB THR A 504 0.367 -4.528 -28.354 1.00 30.44 H new ATOM 0 HG1 THR A 504 -1.024 -3.362 -29.652 1.00 24.35 H new ATOM 0 HG21 THR A 504 -1.772 -5.380 -28.672 1.00 31.26 H new ATOM 0 HG22 THR A 504 -1.220 -5.731 -27.230 1.00 31.26 H new ATOM 0 HG23 THR A 504 -2.275 -4.564 -27.411 1.00 31.26 H new ATOM 1139 N GLN A 505 2.191 -2.524 -27.691 1.00 25.04 N ATOM 1140 CA GLN A 505 3.172 -1.534 -28.146 1.00 25.54 C ATOM 1141 C GLN A 505 2.537 -0.562 -29.182 1.00 28.35 C ATOM 1142 O GLN A 505 3.077 0.523 -29.419 1.00 28.94 O ATOM 1143 CB GLN A 505 4.400 -2.285 -28.739 1.00 27.28 C ATOM 1144 CG GLN A 505 5.620 -1.406 -29.006 1.00 44.28 C ATOM 1145 CD GLN A 505 6.716 -2.116 -29.768 1.00 53.76 C ATOM 1146 OE1 GLN A 505 7.026 -3.302 -29.545 1.00 46.29 O ATOM 1147 NE2 GLN A 505 7.360 -1.383 -30.656 1.00 36.17 N ATOM 0 H GLN A 505 2.394 -3.330 -27.911 1.00 25.04 H new ATOM 0 HA GLN A 505 3.465 -0.992 -27.397 1.00 25.54 H new ATOM 0 HB2 GLN A 505 4.655 -2.994 -28.128 1.00 27.28 H new ATOM 0 HB3 GLN A 505 4.134 -2.708 -29.570 1.00 27.28 H new ATOM 0 HG2 GLN A 505 5.343 -0.623 -29.506 1.00 44.28 H new ATOM 0 HG3 GLN A 505 5.975 -1.091 -28.160 1.00 44.28 H new ATOM 0 HE21 GLN A 505 7.126 -0.567 -30.791 1.00 36.17 H new ATOM 0 HE22 GLN A 505 8.014 -1.722 -31.100 1.00 36.17 H new ATOM 1148 N HIS A 506 1.375 -0.941 -29.765 1.00 24.34 N ATOM 1149 CA HIS A 506 0.637 -0.174 -30.782 1.00 23.89 C ATOM 1150 C HIS A 506 -0.784 0.245 -30.375 1.00 27.54 C ATOM 1151 O HIS A 506 -1.596 0.576 -31.243 1.00 27.78 O ATOM 1152 CB HIS A 506 0.599 -0.969 -32.105 1.00 25.06 C ATOM 1153 CG HIS A 506 1.971 -1.284 -32.604 1.00 28.48 C ATOM 1154 ND1 HIS A 506 2.716 -0.347 -33.304 1.00 29.90 N ATOM 1155 CD2 HIS A 506 2.713 -2.403 -32.438 1.00 29.97 C ATOM 1156 CE1 HIS A 506 3.877 -0.930 -33.546 1.00 29.73 C ATOM 1157 NE2 HIS A 506 3.918 -2.169 -33.049 1.00 29.91 N ATOM 0 H HIS A 506 0.987 -1.682 -29.565 1.00 24.34 H new ATOM 0 HA HIS A 506 1.125 0.657 -30.890 1.00 23.89 H new ATOM 0 HB2 HIS A 506 0.106 -1.794 -31.972 1.00 25.06 H new ATOM 0 HB3 HIS A 506 0.121 -0.457 -32.776 1.00 25.06 H new ATOM 0 HD1 HIS A 506 2.474 0.446 -33.532 1.00 29.90 H new ATOM 0 HD2 HIS A 506 2.456 -3.180 -31.996 1.00 29.97 H new ATOM 0 HE1 HIS A 506 4.578 -0.528 -34.005 1.00 29.73 H new ATOM 1158 N TYR A 507 -1.096 0.243 -29.065 1.00 23.69 N ATOM 1159 CA TYR A 507 -2.441 0.589 -28.609 1.00 22.84 C ATOM 1160 C TYR A 507 -2.381 1.257 -27.233 1.00 25.45 C ATOM 1161 O TYR A 507 -2.141 0.575 -26.233 1.00 23.11 O ATOM 1162 CB TYR A 507 -3.312 -0.704 -28.596 1.00 24.45 C ATOM 1163 CG TYR A 507 -4.793 -0.559 -28.295 1.00 26.80 C ATOM 1164 CD1 TYR A 507 -5.386 0.696 -28.172 1.00 27.93 C ATOM 1165 CD2 TYR A 507 -5.606 -1.680 -28.146 1.00 28.49 C ATOM 1166 CE1 TYR A 507 -6.741 0.832 -27.870 1.00 27.89 C ATOM 1167 CE2 TYR A 507 -6.966 -1.556 -27.845 1.00 29.74 C ATOM 1168 CZ TYR A 507 -7.530 -0.298 -27.719 1.00 33.43 C ATOM 1169 OH TYR A 507 -8.870 -0.167 -27.440 1.00 31.59 O ATOM 0 H TYR A 507 -0.544 0.045 -28.436 1.00 23.69 H new ATOM 0 HA TYR A 507 -2.848 1.229 -29.214 1.00 22.84 H new ATOM 0 HB2 TYR A 507 -3.225 -1.130 -29.463 1.00 24.45 H new ATOM 0 HB3 TYR A 507 -2.933 -1.312 -27.942 1.00 24.45 H new ATOM 0 HD1 TYR A 507 -4.868 1.459 -28.294 1.00 27.93 H new ATOM 0 HD2 TYR A 507 -5.237 -2.528 -28.249 1.00 28.49 H new ATOM 0 HE1 TYR A 507 -7.114 1.678 -27.770 1.00 27.89 H new ATOM 0 HE2 TYR A 507 -7.490 -2.316 -27.730 1.00 29.74 H new ATOM 0 HH TYR A 507 -9.031 0.622 -27.202 1.00 31.59 H new ATOM 1170 N ALA A 508 -2.584 2.595 -27.200 1.00 22.08 N ATOM 1171 CA ALA A 508 -2.578 3.404 -25.979 1.00 21.55 C ATOM 1172 C ALA A 508 -4.002 3.774 -25.519 1.00 24.60 C ATOM 1173 O ALA A 508 -4.873 4.027 -26.350 1.00 23.49 O ATOM 1174 CB ALA A 508 -1.774 4.677 -26.215 1.00 22.22 C ATOM 0 H ALA A 508 -2.731 3.058 -27.910 1.00 22.08 H new ATOM 0 HA ALA A 508 -2.171 2.872 -25.277 1.00 21.55 H new ATOM 0 HB1 ALA A 508 -1.770 5.212 -25.406 1.00 22.22 H new ATOM 0 HB2 ALA A 508 -0.863 4.445 -26.453 1.00 22.22 H new ATOM 0 HB3 ALA A 508 -2.177 5.185 -26.937 1.00 22.22 H new ATOM 1175 N LYS A 509 -4.202 3.878 -24.195 1.00 20.63 N ATOM 1176 CA LYS A 509 -5.467 4.311 -23.591 1.00 19.70 C ATOM 1177 C LYS A 509 -5.201 5.393 -22.528 1.00 22.20 C ATOM 1178 O LYS A 509 -4.177 5.363 -21.851 1.00 19.91 O ATOM 1179 CB LYS A 509 -6.216 3.133 -22.928 1.00 20.85 C ATOM 1180 CG LYS A 509 -6.867 2.169 -23.922 1.00 22.57 C ATOM 1181 CD LYS A 509 -7.467 0.993 -23.183 1.00 26.09 C ATOM 1182 CE LYS A 509 -8.289 0.107 -24.082 1.00 34.10 C ATOM 1183 NZ LYS A 509 -9.727 0.467 -24.012 1.00 40.15 N ATOM 0 H LYS A 509 -3.593 3.695 -23.616 1.00 20.63 H new ATOM 0 HA LYS A 509 -6.021 4.668 -24.303 1.00 19.70 H new ATOM 0 HB2 LYS A 509 -5.594 2.638 -22.372 1.00 20.85 H new ATOM 0 HB3 LYS A 509 -6.901 3.488 -22.340 1.00 20.85 H new ATOM 0 HG2 LYS A 509 -7.556 2.629 -24.427 1.00 22.57 H new ATOM 0 HG3 LYS A 509 -6.207 1.857 -24.561 1.00 22.57 H new ATOM 0 HD2 LYS A 509 -6.756 0.470 -22.781 1.00 26.09 H new ATOM 0 HD3 LYS A 509 -8.023 1.319 -22.459 1.00 26.09 H new ATOM 0 HE2 LYS A 509 -7.976 0.188 -24.996 1.00 34.10 H new ATOM 0 HE3 LYS A 509 -8.171 -0.820 -23.823 1.00 34.10 H new ATOM 0 HZ1 LYS A 509 -10.170 0.047 -24.660 1.00 40.15 H new ATOM 0 HZ2 LYS A 509 -10.056 0.223 -23.222 1.00 40.15 H new ATOM 0 HZ3 LYS A 509 -9.818 1.347 -24.113 1.00 40.15 H new ATOM 1184 N ILE A 510 -6.148 6.315 -22.359 1.00 19.57 N ATOM 1185 CA ILE A 510 -6.049 7.360 -21.341 1.00 20.36 C ATOM 1186 C ILE A 510 -6.610 6.805 -20.044 1.00 23.80 C ATOM 1187 O ILE A 510 -7.658 6.150 -20.059 1.00 23.91 O ATOM 1188 CB ILE A 510 -6.804 8.633 -21.789 1.00 23.78 C ATOM 1189 CG1 ILE A 510 -6.223 9.184 -23.105 1.00 23.67 C ATOM 1190 CG2 ILE A 510 -6.835 9.691 -20.681 1.00 24.91 C ATOM 1191 CD1 ILE A 510 -7.188 9.978 -23.904 1.00 24.33 C ATOM 0 H ILE A 510 -6.866 6.352 -22.831 1.00 19.57 H new ATOM 0 HA ILE A 510 -5.123 7.617 -21.209 1.00 20.36 H new ATOM 0 HB ILE A 510 -7.726 8.388 -21.962 1.00 23.78 H new ATOM 0 HG12 ILE A 510 -5.453 9.738 -22.901 1.00 23.67 H new ATOM 0 HG13 ILE A 510 -5.905 8.442 -23.643 1.00 23.67 H new ATOM 0 HG21 ILE A 510 -7.314 10.474 -20.994 1.00 24.91 H new ATOM 0 HG22 ILE A 510 -7.283 9.329 -19.900 1.00 24.91 H new ATOM 0 HG23 ILE A 510 -5.928 9.941 -20.446 1.00 24.91 H new ATOM 0 HD11 ILE A 510 -6.757 10.292 -24.714 1.00 24.33 H new ATOM 0 HD12 ILE A 510 -7.949 9.423 -24.137 1.00 24.33 H new ATOM 0 HD13 ILE A 510 -7.490 10.739 -23.384 1.00 24.33 H new ATOM 1192 N SER A 511 -5.933 7.083 -18.925 1.00 21.44 N ATOM 1193 CA SER A 511 -6.400 6.633 -17.621 1.00 21.46 C ATOM 1194 C SER A 511 -6.346 7.759 -16.581 1.00 23.63 C ATOM 1195 O SER A 511 -5.934 8.894 -16.883 1.00 21.85 O ATOM 1196 CB SER A 511 -5.561 5.445 -17.151 1.00 25.76 C ATOM 1197 OG SER A 511 -4.239 5.843 -16.805 1.00 34.90 O ATOM 0 H SER A 511 -5.200 7.532 -18.905 1.00 21.44 H new ATOM 0 HA SER A 511 -7.326 6.361 -17.713 1.00 21.46 H new ATOM 0 HB2 SER A 511 -5.986 5.031 -16.384 1.00 25.76 H new ATOM 0 HB3 SER A 511 -5.525 4.775 -17.852 1.00 25.76 H new ATOM 0 HG SER A 511 -3.950 6.385 -17.378 1.00 34.90 H new ATOM 1198 N ASP A 512 -6.663 7.394 -15.328 1.00 21.80 N ATOM 1199 CA ASP A 512 -6.581 8.250 -14.151 1.00 21.73 C ATOM 1200 C ASP A 512 -7.449 9.499 -14.226 1.00 25.39 C ATOM 1201 O ASP A 512 -6.964 10.617 -14.455 1.00 25.12 O ATOM 1202 CB ASP A 512 -5.116 8.581 -13.791 1.00 23.36 C ATOM 1203 CG ASP A 512 -4.939 9.125 -12.382 1.00 37.57 C ATOM 1204 OD1 ASP A 512 -5.968 9.400 -11.711 1.00 37.73 O ATOM 1205 OD2 ASP A 512 -3.785 9.292 -11.957 1.00 44.34 O1- ATOM 0 H ASP A 512 -6.944 6.603 -15.142 1.00 21.80 H new ATOM 0 HA ASP A 512 -6.957 7.729 -13.424 1.00 21.73 H new ATOM 0 HB2 ASP A 512 -4.578 7.780 -13.889 1.00 23.36 H new ATOM 0 HB3 ASP A 512 -4.775 9.231 -14.425 1.00 23.36 H new ATOM 1206 N PHE A 513 -8.733 9.295 -13.930 1.00 23.91 N ATOM 1207 CA PHE A 513 -9.770 10.328 -13.915 1.00 23.37 C ATOM 1208 C PHE A 513 -10.002 10.912 -12.505 1.00 27.03 C ATOM 1209 O PHE A 513 -11.054 11.503 -12.249 1.00 26.88 O ATOM 1210 CB PHE A 513 -11.063 9.793 -14.591 1.00 24.56 C ATOM 1211 CG PHE A 513 -10.863 9.581 -16.076 1.00 25.83 C ATOM 1212 CD1 PHE A 513 -10.401 8.362 -16.567 1.00 28.08 C ATOM 1213 CD2 PHE A 513 -11.043 10.627 -16.975 1.00 26.77 C ATOM 1214 CE1 PHE A 513 -10.181 8.179 -17.940 1.00 28.43 C ATOM 1215 CE2 PHE A 513 -10.831 10.439 -18.346 1.00 29.82 C ATOM 1216 CZ PHE A 513 -10.382 9.223 -18.819 1.00 27.26 C ATOM 0 H PHE A 513 -9.036 8.517 -13.724 1.00 23.91 H new ATOM 0 HA PHE A 513 -9.462 11.083 -14.441 1.00 23.37 H new ATOM 0 HB2 PHE A 513 -11.325 8.956 -14.176 1.00 24.56 H new ATOM 0 HB3 PHE A 513 -11.789 10.420 -14.447 1.00 24.56 H new ATOM 0 HD1 PHE A 513 -10.237 7.662 -15.978 1.00 28.08 H new ATOM 0 HD2 PHE A 513 -11.307 11.462 -16.661 1.00 26.77 H new ATOM 0 HE1 PHE A 513 -9.899 7.352 -18.259 1.00 28.43 H new ATOM 0 HE2 PHE A 513 -10.993 11.136 -18.940 1.00 29.82 H new ATOM 0 HZ PHE A 513 -10.216 9.108 -19.727 1.00 27.26 H new ATOM 1217 N GLY A 514 -8.983 10.801 -11.645 1.00 24.73 N ATOM 1218 CA GLY A 514 -8.965 11.302 -10.265 1.00 24.26 C ATOM 1219 C GLY A 514 -9.220 12.792 -10.089 1.00 28.64 C ATOM 1220 O GLY A 514 -9.837 13.182 -9.098 1.00 29.93 O ATOM 0 H GLY A 514 -8.247 10.412 -11.862 1.00 24.73 H new ATOM 0 HA2 GLY A 514 -9.632 10.816 -9.755 1.00 24.26 H new ATOM 0 HA3 GLY A 514 -8.102 11.092 -9.875 1.00 24.26 H new ATOM 1221 N LEU A 515 -8.747 13.646 -11.037 1.00 23.43 N ATOM 1222 CA LEU A 515 -8.964 15.105 -10.979 1.00 23.22 C ATOM 1223 C LEU A 515 -9.995 15.568 -12.045 1.00 25.58 C ATOM 1224 O LEU A 515 -10.210 16.769 -12.203 1.00 24.40 O ATOM 1225 CB LEU A 515 -7.628 15.879 -11.168 1.00 23.02 C ATOM 1226 CG LEU A 515 -6.558 15.733 -10.064 1.00 29.46 C ATOM 1227 CD1 LEU A 515 -5.198 16.292 -10.545 1.00 28.46 C ATOM 1228 CD2 LEU A 515 -6.981 16.459 -8.786 1.00 33.00 C ATOM 0 H LEU A 515 -8.296 13.388 -11.723 1.00 23.43 H new ATOM 0 HA LEU A 515 -9.320 15.305 -10.099 1.00 23.22 H new ATOM 0 HB2 LEU A 515 -7.233 15.595 -12.007 1.00 23.02 H new ATOM 0 HB3 LEU A 515 -7.838 16.822 -11.259 1.00 23.02 H new ATOM 0 HG LEU A 515 -6.466 14.787 -9.871 1.00 29.46 H new ATOM 0 HD11 LEU A 515 -4.539 16.192 -9.840 1.00 28.46 H new ATOM 0 HD12 LEU A 515 -4.907 15.803 -11.331 1.00 28.46 H new ATOM 0 HD13 LEU A 515 -5.294 17.232 -10.766 1.00 28.46 H new ATOM 0 HD21 LEU A 515 -6.293 16.352 -8.110 1.00 33.00 H new ATOM 0 HD22 LEU A 515 -7.104 17.402 -8.975 1.00 33.00 H new ATOM 0 HD23 LEU A 515 -7.814 16.084 -8.461 1.00 33.00 H new ATOM 1229 N SER A 516 -10.608 14.613 -12.783 1.00 21.27 N ATOM 1230 CA SER A 516 -11.537 14.941 -13.860 1.00 22.06 C ATOM 1231 C SER A 516 -12.871 15.558 -13.413 1.00 27.18 C ATOM 1232 O SER A 516 -13.361 15.269 -12.314 1.00 25.18 O ATOM 1233 CB SER A 516 -11.764 13.738 -14.764 1.00 26.78 C ATOM 1234 OG SER A 516 -10.505 13.338 -15.283 1.00 38.95 O ATOM 0 H SER A 516 -10.490 13.769 -12.665 1.00 21.27 H new ATOM 0 HA SER A 516 -11.099 15.647 -14.360 1.00 22.06 H new ATOM 0 HB2 SER A 516 -12.172 13.012 -14.267 1.00 26.78 H new ATOM 0 HB3 SER A 516 -12.372 13.965 -15.485 1.00 26.78 H new ATOM 0 HG SER A 516 -9.971 13.986 -15.254 1.00 38.95 H new ATOM 1235 N LYS A 517 -13.445 16.409 -14.273 1.00 23.45 N ATOM 1236 CA LYS A 517 -14.711 17.078 -13.975 1.00 23.23 C ATOM 1237 C LYS A 517 -15.635 17.055 -15.157 1.00 26.98 C ATOM 1238 O LYS A 517 -15.192 17.303 -16.279 1.00 27.35 O ATOM 1239 CB LYS A 517 -14.493 18.551 -13.544 1.00 25.44 C ATOM 1240 CG LYS A 517 -13.588 18.789 -12.327 1.00 29.14 C ATOM 1241 CD LYS A 517 -14.237 18.421 -11.013 1.00 31.45 C ATOM 1242 CE LYS A 517 -13.178 18.365 -9.941 1.00 41.27 C ATOM 1243 NZ LYS A 517 -13.758 18.029 -8.612 1.00 44.85 N ATOM 0 H LYS A 517 -13.111 16.611 -15.039 1.00 23.45 H new ATOM 0 HA LYS A 517 -15.113 16.587 -13.241 1.00 23.23 H new ATOM 0 HB2 LYS A 517 -14.120 19.034 -14.298 1.00 25.44 H new ATOM 0 HB3 LYS A 517 -15.360 18.943 -13.357 1.00 25.44 H new ATOM 0 HG2 LYS A 517 -12.773 18.273 -12.433 1.00 29.14 H new ATOM 0 HG3 LYS A 517 -13.331 19.724 -12.302 1.00 29.14 H new ATOM 0 HD2 LYS A 517 -14.915 19.074 -10.780 1.00 31.45 H new ATOM 0 HD3 LYS A 517 -14.683 17.563 -11.088 1.00 31.45 H new ATOM 0 HE2 LYS A 517 -12.510 17.703 -10.180 1.00 41.27 H new ATOM 0 HE3 LYS A 517 -12.724 19.221 -9.889 1.00 41.27 H new ATOM 0 HZ1 LYS A 517 -13.112 17.749 -8.068 1.00 44.85 H new ATOM 0 HZ2 LYS A 517 -14.145 18.752 -8.266 1.00 44.85 H new ATOM 0 HZ3 LYS A 517 -14.365 17.385 -8.707 1.00 44.85 H new ATOM 1244 N ALA A 518 -16.940 16.823 -14.901 1.00 23.98 N ATOM 1245 CA ALA A 518 -17.999 16.916 -15.907 1.00 23.02 C ATOM 1246 C ALA A 518 -18.336 18.393 -15.957 1.00 26.13 C ATOM 1247 O ALA A 518 -18.620 18.990 -14.914 1.00 26.39 O ATOM 1248 CB ALA A 518 -19.222 16.099 -15.470 1.00 23.52 C ATOM 0 H ALA A 518 -17.229 16.604 -14.121 1.00 23.98 H new ATOM 0 HA ALA A 518 -17.727 16.568 -16.771 1.00 23.02 H new ATOM 0 HB1 ALA A 518 -19.916 16.169 -16.144 1.00 23.52 H new ATOM 0 HB2 ALA A 518 -18.968 15.169 -15.363 1.00 23.52 H new ATOM 0 HB3 ALA A 518 -19.556 16.442 -14.626 1.00 23.52 H new ATOM 1249 N LEU A 519 -18.264 19.020 -17.142 1.00 23.19 N ATOM 1250 CA LEU A 519 -18.559 20.451 -17.183 1.00 23.63 C ATOM 1251 C LEU A 519 -20.050 20.746 -17.034 1.00 27.71 C ATOM 1252 O LEU A 519 -20.891 19.971 -17.497 1.00 27.59 O ATOM 1253 CB LEU A 519 -18.008 21.126 -18.459 1.00 23.61 C ATOM 1254 CG LEU A 519 -16.479 21.126 -18.648 1.00 28.45 C ATOM 1255 CD1 LEU A 519 -16.123 21.608 -20.052 1.00 29.75 C ATOM 1256 CD2 LEU A 519 -15.785 21.988 -17.612 1.00 25.53 C ATOM 0 H LEU A 519 -18.057 18.655 -17.893 1.00 23.19 H new ATOM 0 HA LEU A 519 -18.102 20.833 -16.417 1.00 23.63 H new ATOM 0 HB2 LEU A 519 -18.406 20.688 -19.227 1.00 23.61 H new ATOM 0 HB3 LEU A 519 -18.313 22.047 -18.468 1.00 23.61 H new ATOM 0 HG LEU A 519 -16.168 20.215 -18.531 1.00 28.45 H new ATOM 0 HD11 LEU A 519 -15.159 21.604 -20.161 1.00 29.75 H new ATOM 0 HD12 LEU A 519 -16.524 21.017 -20.709 1.00 29.75 H new ATOM 0 HD13 LEU A 519 -16.459 22.509 -20.180 1.00 29.75 H new ATOM 0 HD21 LEU A 519 -14.827 21.965 -17.761 1.00 25.53 H new ATOM 0 HD22 LEU A 519 -16.101 22.902 -17.687 1.00 25.53 H new ATOM 0 HD23 LEU A 519 -15.982 21.650 -16.725 1.00 25.53 H new ATOM 1257 N ARG A 520 -20.366 21.874 -16.393 1.00 23.21 N ATOM 1258 CA ARG A 520 -21.743 22.360 -16.231 1.00 23.80 C ATOM 1259 C ARG A 520 -22.300 22.688 -17.615 1.00 26.31 C ATOM 1260 O ARG A 520 -21.537 23.142 -18.472 1.00 25.01 O ATOM 1261 CB ARG A 520 -21.745 23.621 -15.369 1.00 24.39 C ATOM 1262 CG ARG A 520 -21.661 23.349 -13.867 1.00 29.27 C ATOM 1263 CD ARG A 520 -21.561 24.664 -13.077 1.00 38.08 C ATOM 1264 NE ARG A 520 -22.566 25.661 -13.487 1.00 41.19 N ATOM 1265 CZ ARG A 520 -23.350 26.333 -12.650 1.00 49.99 C ATOM 1266 NH1 ARG A 520 -23.265 26.128 -11.344 1.00 36.94 N ATOM 1267 NH2 ARG A 520 -24.225 27.217 -13.114 1.00 38.63 N ATOM 0 H ARG A 520 -19.777 22.388 -16.034 1.00 23.21 H new ATOM 0 HA ARG A 520 -22.288 21.683 -15.800 1.00 23.80 H new ATOM 0 HB2 ARG A 520 -20.996 24.180 -15.629 1.00 24.39 H new ATOM 0 HB3 ARG A 520 -22.553 24.125 -15.552 1.00 24.39 H new ATOM 0 HG2 ARG A 520 -22.444 22.853 -13.580 1.00 29.27 H new ATOM 0 HG3 ARG A 520 -20.888 22.794 -13.678 1.00 29.27 H new ATOM 0 HD2 ARG A 520 -21.667 24.476 -12.131 1.00 38.08 H new ATOM 0 HD3 ARG A 520 -20.674 25.039 -13.194 1.00 38.08 H new ATOM 0 HE ARG A 520 -22.651 25.819 -14.328 1.00 41.19 H new ATOM 0 HH11 ARG A 520 -22.701 25.558 -11.034 1.00 36.94 H new ATOM 0 HH12 ARG A 520 -23.774 26.565 -10.806 1.00 36.94 H new ATOM 0 HH21 ARG A 520 -24.287 27.357 -13.960 1.00 38.63 H new ATOM 0 HH22 ARG A 520 -24.730 27.649 -12.568 1.00 38.63 H new ATOM 1268 N ALA A 521 -23.614 22.437 -17.846 1.00 23.06 N ATOM 1269 CA ALA A 521 -24.270 22.706 -19.146 1.00 23.42 C ATOM 1270 C ALA A 521 -24.164 24.173 -19.619 1.00 28.62 C ATOM 1271 O ALA A 521 -24.290 24.434 -20.824 1.00 29.00 O ATOM 1272 CB ALA A 521 -25.741 22.288 -19.086 1.00 24.46 C ATOM 0 H ALA A 521 -24.142 22.108 -17.253 1.00 23.06 H new ATOM 0 HA ALA A 521 -23.788 22.176 -19.800 1.00 23.42 H new ATOM 0 HB1 ALA A 521 -26.164 22.467 -19.941 1.00 24.46 H new ATOM 0 HB2 ALA A 521 -25.800 21.340 -18.889 1.00 24.46 H new ATOM 0 HB3 ALA A 521 -26.193 22.791 -18.391 1.00 24.46 H new ATOM 1273 N ASP A 522 -23.923 25.124 -18.687 1.00 26.31 N ATOM 1274 CA ASP A 522 -23.836 26.561 -18.985 1.00 28.10 C ATOM 1275 C ASP A 522 -22.394 27.141 -18.992 1.00 34.75 C ATOM 1276 O ASP A 522 -22.228 28.358 -19.093 1.00 34.79 O ATOM 1277 CB ASP A 522 -24.731 27.358 -17.995 1.00 30.42 C ATOM 1278 CG ASP A 522 -24.280 27.285 -16.538 1.00 37.03 C ATOM 1279 OD1 ASP A 522 -23.567 26.322 -16.179 1.00 36.65 O ATOM 1280 OD2 ASP A 522 -24.701 28.148 -15.744 1.00 40.03 O1- ATOM 0 H ASP A 522 -23.805 24.941 -17.855 1.00 26.31 H new ATOM 0 HA ASP A 522 -24.155 26.661 -19.895 1.00 28.10 H new ATOM 0 HB2 ASP A 522 -24.750 28.288 -18.270 1.00 30.42 H new ATOM 0 HB3 ASP A 522 -25.640 27.025 -18.058 1.00 30.42 H new ATOM 1281 N GLU A 523 -21.366 26.278 -18.889 1.00 32.59 N ATOM 1282 CA GLU A 523 -19.963 26.715 -18.846 1.00 32.17 C ATOM 1283 C GLU A 523 -19.045 25.833 -19.669 1.00 32.89 C ATOM 1284 O GLU A 523 -19.214 24.614 -19.708 1.00 30.13 O ATOM 1285 CB GLU A 523 -19.444 26.765 -17.392 1.00 33.82 C ATOM 1286 CG GLU A 523 -20.017 27.885 -16.523 1.00 44.92 C ATOM 1287 CD GLU A 523 -19.709 29.327 -16.905 1.00 72.43 C ATOM 1288 OE1 GLU A 523 -20.523 30.209 -16.549 1.00 63.49 O ATOM 1289 OE2 GLU A 523 -18.666 29.581 -17.553 1.00 69.02 O1- ATOM 0 H GLU A 523 -21.467 25.425 -18.842 1.00 32.59 H new ATOM 0 HA GLU A 523 -19.950 27.604 -19.234 1.00 32.17 H new ATOM 0 HB2 GLU A 523 -19.640 25.915 -16.967 1.00 33.82 H new ATOM 0 HB3 GLU A 523 -18.479 26.856 -17.413 1.00 33.82 H new ATOM 0 HG2 GLU A 523 -20.981 27.783 -16.507 1.00 44.92 H new ATOM 0 HG3 GLU A 523 -19.702 27.746 -15.616 1.00 44.92 H new ATOM 1290 N ASN A 524 -18.020 26.460 -20.254 1.00 30.00 N ATOM 1291 CA ASN A 524 -16.972 25.837 -21.070 1.00 29.94 C ATOM 1292 C ASN A 524 -15.705 25.519 -20.236 1.00 31.18 C ATOM 1293 O ASN A 524 -14.715 24.990 -20.757 1.00 29.41 O ATOM 1294 CB ASN A 524 -16.622 26.796 -22.233 1.00 35.14 C ATOM 1295 CG ASN A 524 -16.041 26.135 -23.456 1.00 66.30 C ATOM 1296 OD1 ASN A 524 -16.566 24.974 -23.828 1.00 64.59 O flip ATOM 1297 ND2 ASN A 524 -15.141 26.677 -24.107 1.00 59.29 N flip ATOM 0 H ASN A 524 -17.912 27.310 -20.181 1.00 30.00 H new ATOM 0 HA ASN A 524 -17.303 24.993 -21.415 1.00 29.94 H new ATOM 0 HB2 ASN A 524 -17.425 27.274 -22.492 1.00 35.14 H new ATOM 0 HB3 ASN A 524 -15.990 27.457 -21.909 1.00 35.14 H new ATOM 0 HD21 ASN A 524 -14.816 27.429 -23.847 1.00 59.29 H new ATOM 0 HD22 ASN A 524 -14.840 26.302 -24.820 1.00 59.29 H new HETATM 1298 N PTR A 525 -15.743 25.823 -18.943 1.00 27.15 N HETATM 1299 CA PTR A 525 -14.615 25.574 -18.061 1.00 27.22 C HETATM 1300 C PTR A 525 -15.068 25.269 -16.647 1.00 29.45 C HETATM 1301 O PTR A 525 -16.185 25.627 -16.246 1.00 30.18 O HETATM 1302 CB PTR A 525 -13.584 26.772 -17.990 1.00 30.38 C HETATM 1303 CG PTR A 525 -14.250 28.045 -17.427 1.00 34.39 C HETATM 1304 CD1 PTR A 525 -14.256 28.246 -16.041 1.00 36.71 C HETATM 1305 CD2 PTR A 525 -14.889 28.995 -18.277 1.00 36.62 C HETATM 1306 CE1 PTR A 525 -14.892 29.351 -15.479 1.00 40.26 C HETATM 1307 CE2 PTR A 525 -15.522 30.132 -17.712 1.00 39.35 C HETATM 1308 CZ PTR A 525 -15.509 30.314 -16.303 1.00 42.70 C HETATM 1309 OH PTR A 525 -16.135 31.330 -15.610 1.00 49.30 O HETATM 1310 P PTR A 525 -16.024 32.806 -16.032 1.00 53.80 P HETATM 1311 O1P PTR A 525 -16.159 33.004 -17.554 1.00 53.93 O1- HETATM 1312 O2P PTR A 525 -17.168 33.496 -15.284 1.00 55.07 O1- HETATM 1313 O3P PTR A 525 -14.706 33.334 -15.484 1.00 55.13 O HETATM 0 HE2 PTR A 525 -15.961 30.781 -18.284 1.00 39.35 H new HETATM 0 HE1 PTR A 525 -14.910 29.458 -14.515 1.00 40.26 H new HETATM 0 HD2 PTR A 525 -14.891 28.864 -19.238 1.00 36.62 H new HETATM 0 HD1 PTR A 525 -13.811 27.606 -15.464 1.00 36.71 H new HETATM 0 HB3 PTR A 525 -12.832 26.523 -17.431 1.00 30.38 H new HETATM 0 HB2 PTR A 525 -13.232 26.952 -18.876 1.00 30.38 H new HETATM 0 HA PTR A 525 -14.168 24.807 -18.452 1.00 27.22 H new HETATM 0 H PTR A 525 -16.545 25.786 -18.636 1.00 27.15 H new HETATM 1314 N PTR A 526 -14.184 24.632 -15.881 1.00 25.02 N HETATM 1315 CA PTR A 526 -14.402 24.349 -14.466 1.00 25.81 C HETATM 1316 C PTR A 526 -13.507 25.304 -13.671 1.00 30.70 C HETATM 1317 O PTR A 526 -12.294 25.364 -13.910 1.00 28.14 O HETATM 1318 CB PTR A 526 -14.018 22.904 -14.136 1.00 27.09 C HETATM 1319 CG PTR A 526 -13.778 22.612 -12.665 1.00 29.63 C HETATM 1320 CD1 PTR A 526 -14.876 22.416 -11.781 1.00 31.40 C HETATM 1321 CD2 PTR A 526 -12.475 22.506 -12.194 1.00 31.85 C HETATM 1322 CE1 PTR A 526 -14.646 22.140 -10.425 1.00 33.84 C HETATM 1323 CE2 PTR A 526 -12.234 22.213 -10.838 1.00 34.18 C HETATM 1324 CZ PTR A 526 -13.301 22.033 -9.952 1.00 36.93 C HETATM 1325 OH PTR A 526 -12.904 21.727 -8.698 1.00 43.56 O HETATM 1326 P PTR A 526 -13.909 21.579 -7.535 1.00 49.51 P HETATM 1327 O1P PTR A 526 -14.864 20.402 -7.758 1.00 50.12 O HETATM 1328 O2P PTR A 526 -14.720 22.861 -7.305 1.00 50.30 O1- HETATM 1329 O3P PTR A 526 -13.036 21.298 -6.319 1.00 50.39 O1- HETATM 0 HE2 PTR A 526 -11.322 22.136 -10.516 1.00 34.18 H new HETATM 0 HE1 PTR A 526 -15.391 22.023 -9.815 1.00 33.84 H new HETATM 0 HD2 PTR A 526 -11.729 22.634 -12.801 1.00 31.85 H new HETATM 0 HD1 PTR A 526 -15.784 22.473 -12.116 1.00 31.40 H new HETATM 0 HB3 PTR A 526 -14.721 22.318 -14.456 1.00 27.09 H new HETATM 0 HB2 PTR A 526 -13.214 22.678 -14.630 1.00 27.09 H new HETATM 0 HA PTR A 526 -15.338 24.469 -14.243 1.00 25.81 H new ATOM 1330 N LYS A 527 -14.097 26.033 -12.711 1.00 27.88 N ATOM 1331 CA LYS A 527 -13.351 26.952 -11.867 1.00 28.98 C ATOM 1332 C LYS A 527 -13.089 26.266 -10.537 1.00 36.13 C ATOM 1333 O LYS A 527 -14.039 25.940 -9.821 1.00 36.71 O ATOM 1334 CB LYS A 527 -14.102 28.304 -11.713 1.00 32.61 C ATOM 1335 CG LYS A 527 -13.640 29.204 -10.553 1.00 42.96 C ATOM 1336 CD LYS A 527 -12.304 29.897 -10.796 1.00 45.43 C ATOM 1337 CE LYS A 527 -11.976 30.888 -9.698 1.00 52.57 C ATOM 1338 NZ LYS A 527 -11.579 30.225 -8.416 1.00 54.58 N ATOM 0 H LYS A 527 -14.939 26.002 -12.539 1.00 27.88 H new ATOM 0 HA LYS A 527 -12.499 27.173 -12.274 1.00 28.98 H new ATOM 0 HB2 LYS A 527 -14.010 28.801 -12.541 1.00 32.61 H new ATOM 0 HB3 LYS A 527 -15.047 28.118 -11.598 1.00 32.61 H new ATOM 0 HG2 LYS A 527 -14.318 29.878 -10.390 1.00 42.96 H new ATOM 0 HG3 LYS A 527 -13.573 28.668 -9.747 1.00 42.96 H new ATOM 0 HD2 LYS A 527 -11.600 29.232 -10.852 1.00 45.43 H new ATOM 0 HD3 LYS A 527 -12.329 30.357 -11.650 1.00 45.43 H new ATOM 0 HE2 LYS A 527 -11.256 31.466 -9.995 1.00 52.57 H new ATOM 0 HE3 LYS A 527 -12.747 31.455 -9.539 1.00 52.57 H new ATOM 0 HZ1 LYS A 527 -12.176 30.418 -7.785 1.00 54.58 H new ATOM 0 HZ2 LYS A 527 -11.547 29.344 -8.535 1.00 54.58 H new ATOM 0 HZ3 LYS A 527 -10.777 30.519 -8.165 1.00 54.58 H new ATOM 1339 N ALA A 528 -11.812 25.968 -10.245 1.00 33.84 N ATOM 1340 CA ALA A 528 -11.437 25.319 -8.992 1.00 35.19 C ATOM 1341 C ALA A 528 -11.572 26.353 -7.875 1.00 44.45 C ATOM 1342 O ALA A 528 -11.239 27.522 -8.077 1.00 40.62 O ATOM 1343 CB ALA A 528 -10.011 24.783 -9.060 1.00 35.68 C ATOM 0 H ALA A 528 -11.150 26.137 -10.767 1.00 33.84 H new ATOM 0 HA ALA A 528 -12.018 24.561 -8.823 1.00 35.19 H new ATOM 0 HB1 ALA A 528 -9.785 24.357 -8.218 1.00 35.68 H new ATOM 0 HB2 ALA A 528 -9.943 24.135 -9.778 1.00 35.68 H new ATOM 0 HB3 ALA A 528 -9.397 25.516 -9.226 1.00 35.68 H new ATOM 1344 N GLN A 529 -12.113 25.931 -6.719 1.00 48.39 N ATOM 1345 CA GLN A 529 -12.353 26.837 -5.592 1.00 51.03 C ATOM 1346 C GLN A 529 -11.059 27.214 -4.886 1.00 60.98 C ATOM 1347 O GLN A 529 -10.776 28.407 -4.709 1.00 61.09 O ATOM 1348 CB GLN A 529 -13.410 26.274 -4.617 1.00 52.35 C ATOM 1349 CG GLN A 529 -14.703 25.759 -5.281 1.00 69.21 C ATOM 1350 CD GLN A 529 -15.631 26.806 -5.878 1.00 89.09 C ATOM 1351 OE1 GLN A 529 -15.307 27.995 -6.013 1.00 86.40 O ATOM 1352 NE2 GLN A 529 -16.820 26.372 -6.273 1.00 77.67 N ATOM 0 H GLN A 529 -12.348 25.117 -6.572 1.00 48.39 H new ATOM 0 HA GLN A 529 -12.721 27.657 -5.956 1.00 51.03 H new ATOM 0 HB2 GLN A 529 -13.011 25.548 -4.113 1.00 52.35 H new ATOM 0 HB3 GLN A 529 -13.644 26.967 -3.980 1.00 52.35 H new ATOM 0 HG2 GLN A 529 -14.455 25.138 -5.984 1.00 69.21 H new ATOM 0 HG3 GLN A 529 -15.202 25.254 -4.620 1.00 69.21 H new ATOM 0 HE21 GLN A 529 -17.031 25.544 -6.173 1.00 77.67 H new ATOM 0 HE22 GLN A 529 -17.381 26.918 -6.629 1.00 77.67 H new ATOM 1353 N THR A 530 -10.256 26.194 -4.529 1.00 60.71 N ATOM 1354 CA THR A 530 -8.957 26.353 -3.875 1.00 61.44 C ATOM 1355 C THR A 530 -7.920 25.486 -4.596 1.00 66.31 C ATOM 1356 O THR A 530 -8.243 24.384 -5.060 1.00 66.52 O ATOM 1357 CB THR A 530 -9.041 25.971 -2.382 1.00 74.94 C ATOM 1358 OG1 THR A 530 -10.335 26.285 -1.855 1.00 78.39 O ATOM 1359 CG2 THR A 530 -7.959 26.644 -1.543 1.00 74.35 C ATOM 0 H THR A 530 -10.465 25.371 -4.668 1.00 60.71 H new ATOM 0 HA THR A 530 -8.689 27.284 -3.925 1.00 61.44 H new ATOM 0 HB THR A 530 -8.893 25.014 -2.330 1.00 74.94 H new ATOM 0 HG1 THR A 530 -10.367 26.071 -1.043 1.00 78.39 H new ATOM 0 HG21 THR A 530 -8.053 26.374 -0.616 1.00 74.35 H new ATOM 0 HG22 THR A 530 -7.085 26.379 -1.869 1.00 74.35 H new ATOM 0 HG23 THR A 530 -8.050 27.607 -1.609 1.00 74.35 H new ATOM 1360 N HIS A 531 -6.677 25.989 -4.682 1.00 62.30 N ATOM 1361 CA HIS A 531 -5.535 25.290 -5.277 1.00 61.80 C ATOM 1362 C HIS A 531 -5.175 24.142 -4.310 1.00 63.63 C ATOM 1363 O HIS A 531 -5.213 24.333 -3.091 1.00 63.70 O ATOM 1364 CB HIS A 531 -4.357 26.286 -5.417 1.00 62.68 C ATOM 1365 CG HIS A 531 -3.187 25.831 -6.245 1.00 66.20 C ATOM 1366 ND1 HIS A 531 -2.522 24.639 -5.985 1.00 67.93 N ATOM 1367 CD2 HIS A 531 -2.531 26.485 -7.234 1.00 67.98 C ATOM 1368 CE1 HIS A 531 -1.529 24.582 -6.858 1.00 67.48 C ATOM 1369 NE2 HIS A 531 -1.491 25.671 -7.629 1.00 67.82 N ATOM 0 H HIS A 531 -6.475 26.770 -4.385 1.00 62.30 H new ATOM 0 HA HIS A 531 -5.735 24.938 -6.158 1.00 61.80 H new ATOM 0 HB2 HIS A 531 -4.699 27.108 -5.801 1.00 62.68 H new ATOM 0 HB3 HIS A 531 -4.034 26.501 -4.528 1.00 62.68 H new ATOM 0 HD1 HIS A 531 -2.716 24.058 -5.381 1.00 67.93 H new ATOM 0 HD2 HIS A 531 -2.742 27.322 -7.580 1.00 67.98 H new ATOM 0 HE1 HIS A 531 -0.932 23.872 -6.926 1.00 67.48 H new ATOM 1370 N GLY A 532 -4.905 22.960 -4.859 1.00 57.84 N ATOM 1371 CA GLY A 532 -4.521 21.779 -4.086 1.00 56.13 C ATOM 1372 C GLY A 532 -3.204 21.215 -4.578 1.00 56.04 C ATOM 1373 O GLY A 532 -2.420 21.950 -5.183 1.00 56.74 O ATOM 0 H GLY A 532 -4.940 22.819 -5.707 1.00 57.84 H new ATOM 0 HA2 GLY A 532 -4.447 22.012 -3.147 1.00 56.13 H new ATOM 0 HA3 GLY A 532 -5.213 21.103 -4.156 1.00 56.13 H new ATOM 1374 N LYS A 533 -2.940 19.911 -4.333 1.00 48.90 N ATOM 1375 CA LYS A 533 -1.721 19.252 -4.832 1.00 46.62 C ATOM 1376 C LYS A 533 -1.924 19.009 -6.338 1.00 43.02 C ATOM 1377 O LYS A 533 -2.621 18.071 -6.726 1.00 41.60 O ATOM 1378 CB LYS A 533 -1.440 17.937 -4.082 1.00 50.19 C ATOM 1379 CG LYS A 533 -0.890 18.119 -2.673 1.00 67.64 C ATOM 1380 CD LYS A 533 -0.506 16.774 -2.073 1.00 80.40 C ATOM 1381 CE LYS A 533 0.007 16.892 -0.659 1.00 93.66 C ATOM 1382 NZ LYS A 533 0.247 15.555 -0.054 1.00103.74 N ATOM 0 H LYS A 533 -3.458 19.396 -3.879 1.00 48.90 H new ATOM 0 HA LYS A 533 -0.946 19.815 -4.680 1.00 46.62 H new ATOM 0 HB2 LYS A 533 -2.262 17.424 -4.033 1.00 50.19 H new ATOM 0 HB3 LYS A 533 -0.809 17.412 -4.598 1.00 50.19 H new ATOM 0 HG2 LYS A 533 -0.115 18.702 -2.695 1.00 67.64 H new ATOM 0 HG3 LYS A 533 -1.555 18.551 -2.114 1.00 67.64 H new ATOM 0 HD2 LYS A 533 -1.278 16.187 -2.085 1.00 80.40 H new ATOM 0 HD3 LYS A 533 0.174 16.360 -2.626 1.00 80.40 H new ATOM 0 HE2 LYS A 533 0.831 17.403 -0.654 1.00 93.66 H new ATOM 0 HE3 LYS A 533 -0.634 17.382 -0.121 1.00 93.66 H new ATOM 0 HZ1 LYS A 533 0.548 15.655 0.777 1.00103.74 H new ATOM 0 HZ2 LYS A 533 -0.514 15.094 -0.040 1.00103.74 H new ATOM 0 HZ3 LYS A 533 0.851 15.114 -0.537 1.00103.74 H new ATOM 1383 N TRP A 534 -1.364 19.902 -7.180 1.00 36.12 N ATOM 1384 CA TRP A 534 -1.557 19.871 -8.636 1.00 33.44 C ATOM 1385 C TRP A 534 -0.312 19.482 -9.468 1.00 32.74 C ATOM 1386 O TRP A 534 0.797 19.902 -9.121 1.00 29.81 O ATOM 1387 CB TRP A 534 -2.062 21.255 -9.110 1.00 32.48 C ATOM 1388 CG TRP A 534 -3.502 21.623 -8.801 1.00 33.79 C ATOM 1389 CD1 TRP A 534 -4.471 20.819 -8.268 1.00 36.90 C ATOM 1390 CD2 TRP A 534 -4.135 22.889 -9.069 1.00 33.21 C ATOM 1391 NE1 TRP A 534 -5.657 21.517 -8.153 1.00 36.42 N ATOM 1392 CE2 TRP A 534 -5.477 22.790 -8.636 1.00 37.49 C ATOM 1393 CE3 TRP A 534 -3.688 24.107 -9.615 1.00 34.35 C ATOM 1394 CZ2 TRP A 534 -6.378 23.864 -8.727 1.00 36.84 C ATOM 1395 CZ3 TRP A 534 -4.582 25.168 -9.718 1.00 35.74 C ATOM 1396 CH2 TRP A 534 -5.912 25.040 -9.282 1.00 36.41 C ATOM 0 H TRP A 534 -0.859 20.545 -6.914 1.00 36.12 H new ATOM 0 HA TRP A 534 -2.205 19.166 -8.792 1.00 33.44 H new ATOM 0 HB2 TRP A 534 -1.490 21.932 -8.717 1.00 32.48 H new ATOM 0 HB3 TRP A 534 -1.941 21.304 -10.071 1.00 32.48 H new ATOM 0 HD1 TRP A 534 -4.349 19.931 -8.019 1.00 36.90 H new ATOM 0 HE1 TRP A 534 -6.391 21.205 -7.831 1.00 36.42 H new ATOM 0 HE3 TRP A 534 -2.809 24.201 -9.902 1.00 34.35 H new ATOM 0 HZ2 TRP A 534 -7.254 23.786 -8.425 1.00 36.84 H new ATOM 0 HZ3 TRP A 534 -4.295 25.975 -10.081 1.00 35.74 H new ATOM 0 HH2 TRP A 534 -6.491 25.763 -9.369 1.00 36.41 H new ATOM 1397 N PRO A 535 -0.489 18.799 -10.644 1.00 27.28 N ATOM 1398 CA PRO A 535 0.669 18.531 -11.530 1.00 26.03 C ATOM 1399 C PRO A 535 1.010 19.802 -12.331 1.00 25.80 C ATOM 1400 O PRO A 535 0.786 19.867 -13.540 1.00 22.46 O ATOM 1401 CB PRO A 535 0.154 17.396 -12.434 1.00 27.42 C ATOM 1402 CG PRO A 535 -1.329 17.636 -12.529 1.00 32.12 C ATOM 1403 CD PRO A 535 -1.744 18.251 -11.210 1.00 27.91 C ATOM 0 HA PRO A 535 1.485 18.286 -11.065 1.00 26.03 H new ATOM 0 HB2 PRO A 535 0.573 17.423 -13.308 1.00 27.42 H new ATOM 0 HB3 PRO A 535 0.348 16.525 -12.053 1.00 27.42 H new ATOM 0 HG2 PRO A 535 -1.537 18.229 -13.268 1.00 32.12 H new ATOM 0 HG3 PRO A 535 -1.805 16.806 -12.689 1.00 32.12 H new ATOM 0 HD2 PRO A 535 -2.407 18.947 -11.338 1.00 27.91 H new ATOM 0 HD3 PRO A 535 -2.138 17.589 -10.620 1.00 27.91 H new ATOM 1404 N VAL A 536 1.527 20.839 -11.634 1.00 22.65 N ATOM 1405 CA VAL A 536 1.819 22.178 -12.181 1.00 23.56 C ATOM 1406 C VAL A 536 2.614 22.226 -13.510 1.00 24.70 C ATOM 1407 O VAL A 536 2.291 23.039 -14.380 1.00 24.63 O ATOM 1408 CB VAL A 536 2.377 23.109 -11.052 1.00 29.71 C ATOM 1409 CG1 VAL A 536 2.955 24.414 -11.608 1.00 30.84 C ATOM 1410 CG2 VAL A 536 1.288 23.401 -10.021 1.00 29.26 C ATOM 0 H VAL A 536 1.723 20.774 -10.799 1.00 22.65 H new ATOM 0 HA VAL A 536 0.967 22.536 -12.478 1.00 23.56 H new ATOM 0 HB VAL A 536 3.106 22.636 -10.621 1.00 29.71 H new ATOM 0 HG11 VAL A 536 3.288 24.958 -10.877 1.00 30.84 H new ATOM 0 HG12 VAL A 536 3.682 24.212 -12.218 1.00 30.84 H new ATOM 0 HG13 VAL A 536 2.262 24.899 -12.082 1.00 30.84 H new ATOM 0 HG21 VAL A 536 1.645 23.978 -9.328 1.00 29.26 H new ATOM 0 HG22 VAL A 536 0.541 23.842 -10.455 1.00 29.26 H new ATOM 0 HG23 VAL A 536 0.986 22.569 -9.625 1.00 29.26 H new ATOM 1411 N LYS A 537 3.604 21.319 -13.700 1.00 20.19 N ATOM 1412 CA LYS A 537 4.391 21.284 -14.941 1.00 18.95 C ATOM 1413 C LYS A 537 3.540 20.903 -16.164 1.00 22.29 C ATOM 1414 O LYS A 537 3.961 21.153 -17.297 1.00 22.76 O ATOM 1415 CB LYS A 537 5.608 20.354 -14.807 1.00 21.20 C ATOM 1416 CG LYS A 537 6.758 20.989 -14.031 1.00 28.97 C ATOM 1417 CD LYS A 537 7.769 19.961 -13.589 1.00 26.80 C ATOM 1418 CE LYS A 537 8.882 20.666 -12.850 1.00 37.04 C ATOM 1419 NZ LYS A 537 9.795 19.719 -12.157 1.00 41.44 N ATOM 0 H LYS A 537 3.827 20.723 -13.121 1.00 20.19 H new ATOM 0 HA LYS A 537 4.715 22.186 -15.089 1.00 18.95 H new ATOM 0 HB2 LYS A 537 5.337 19.536 -14.362 1.00 21.20 H new ATOM 0 HB3 LYS A 537 5.919 20.106 -15.692 1.00 21.20 H new ATOM 0 HG2 LYS A 537 7.194 21.654 -14.586 1.00 28.97 H new ATOM 0 HG3 LYS A 537 6.407 21.453 -13.255 1.00 28.97 H new ATOM 0 HD2 LYS A 537 7.349 19.301 -13.015 1.00 26.80 H new ATOM 0 HD3 LYS A 537 8.123 19.485 -14.357 1.00 26.80 H new ATOM 0 HE2 LYS A 537 9.392 21.203 -13.476 1.00 37.04 H new ATOM 0 HE3 LYS A 537 8.499 21.276 -12.200 1.00 37.04 H new ATOM 0 HZ1 LYS A 537 10.542 20.143 -11.924 1.00 41.44 H new ATOM 0 HZ2 LYS A 537 9.395 19.400 -11.428 1.00 41.44 H new ATOM 0 HZ3 LYS A 537 9.995 19.046 -12.703 1.00 41.44 H new ATOM 1420 N TRP A 538 2.355 20.293 -15.947 1.00 19.50 N ATOM 1421 CA TRP A 538 1.489 19.941 -17.081 1.00 19.83 C ATOM 1422 C TRP A 538 0.362 20.970 -17.286 1.00 23.87 C ATOM 1423 O TRP A 538 -0.426 20.831 -18.225 1.00 23.76 O ATOM 1424 CB TRP A 538 0.935 18.502 -16.941 1.00 18.44 C ATOM 1425 CG TRP A 538 1.957 17.414 -17.155 1.00 19.03 C ATOM 1426 CD1 TRP A 538 2.153 16.680 -18.289 1.00 21.44 C ATOM 1427 CD2 TRP A 538 2.954 16.976 -16.213 1.00 19.11 C ATOM 1428 NE1 TRP A 538 3.234 15.834 -18.124 1.00 20.01 N ATOM 1429 CE2 TRP A 538 3.728 15.982 -16.852 1.00 22.52 C ATOM 1430 CE3 TRP A 538 3.275 17.340 -14.890 1.00 20.80 C ATOM 1431 CZ2 TRP A 538 4.803 15.344 -16.215 1.00 22.74 C ATOM 1432 CZ3 TRP A 538 4.343 16.703 -14.256 1.00 22.94 C ATOM 1433 CH2 TRP A 538 5.117 15.750 -14.929 1.00 23.28 C ATOM 0 H TRP A 538 2.047 20.082 -15.172 1.00 19.50 H new ATOM 0 HA TRP A 538 2.038 19.965 -17.880 1.00 19.83 H new ATOM 0 HB2 TRP A 538 0.552 18.400 -16.056 1.00 18.44 H new ATOM 0 HB3 TRP A 538 0.214 18.382 -17.578 1.00 18.44 H new ATOM 0 HD1 TRP A 538 1.635 16.740 -19.059 1.00 21.44 H new ATOM 0 HE1 TRP A 538 3.547 15.301 -18.722 1.00 20.01 H new ATOM 0 HE3 TRP A 538 2.784 17.994 -14.447 1.00 20.80 H new ATOM 0 HZ2 TRP A 538 5.287 14.673 -16.641 1.00 22.74 H new ATOM 0 HZ3 TRP A 538 4.544 16.915 -13.373 1.00 22.94 H new ATOM 0 HH2 TRP A 538 5.857 15.382 -14.503 1.00 23.28 H new ATOM 1434 N TYR A 539 0.286 22.007 -16.420 1.00 20.55 N ATOM 1435 CA TYR A 539 -0.812 22.987 -16.436 1.00 20.73 C ATOM 1436 C TYR A 539 -0.586 24.248 -17.261 1.00 26.46 C ATOM 1437 O TYR A 539 0.514 24.780 -17.289 1.00 25.43 O ATOM 1438 CB TYR A 539 -1.272 23.340 -14.995 1.00 21.81 C ATOM 1439 CG TYR A 539 -2.178 22.319 -14.320 1.00 22.82 C ATOM 1440 CD1 TYR A 539 -2.544 21.135 -14.969 1.00 24.57 C ATOM 1441 CD2 TYR A 539 -2.707 22.557 -13.053 1.00 23.79 C ATOM 1442 CE1 TYR A 539 -3.376 20.196 -14.353 1.00 24.54 C ATOM 1443 CE2 TYR A 539 -3.545 21.626 -12.429 1.00 24.83 C ATOM 1444 CZ TYR A 539 -3.882 20.451 -13.089 1.00 30.84 C ATOM 1445 OH TYR A 539 -4.702 19.527 -12.489 1.00 28.17 O ATOM 0 H TYR A 539 0.873 22.155 -15.810 1.00 20.55 H new ATOM 0 HA TYR A 539 -1.523 22.525 -16.908 1.00 20.73 H new ATOM 0 HB2 TYR A 539 -0.484 23.463 -14.443 1.00 21.81 H new ATOM 0 HB3 TYR A 539 -1.736 24.192 -15.021 1.00 21.81 H new ATOM 0 HD1 TYR A 539 -2.227 20.969 -15.828 1.00 24.57 H new ATOM 0 HD2 TYR A 539 -2.499 23.350 -12.614 1.00 23.79 H new ATOM 0 HE1 TYR A 539 -3.589 19.403 -14.790 1.00 24.54 H new ATOM 0 HE2 TYR A 539 -3.875 21.793 -11.576 1.00 24.83 H new ATOM 0 HH TYR A 539 -4.650 18.797 -12.900 1.00 28.17 H new ATOM 1446 N ALA A 540 -1.657 24.722 -17.921 1.00 23.99 N ATOM 1447 CA ALA A 540 -1.681 25.923 -18.753 1.00 23.31 C ATOM 1448 C ALA A 540 -1.681 27.182 -17.885 1.00 27.13 C ATOM 1449 O ALA A 540 -2.060 27.094 -16.705 1.00 25.33 O ATOM 1450 CB ALA A 540 -2.914 25.896 -19.652 1.00 23.71 C ATOM 0 H ALA A 540 -2.421 24.328 -17.889 1.00 23.99 H new ATOM 0 HA ALA A 540 -0.884 25.939 -19.305 1.00 23.31 H new ATOM 0 HB1 ALA A 540 -2.930 26.693 -20.204 1.00 23.71 H new ATOM 0 HB2 ALA A 540 -2.883 25.110 -20.220 1.00 23.71 H new ATOM 0 HB3 ALA A 540 -3.714 25.867 -19.104 1.00 23.71 H new ATOM 1451 N PRO A 541 -1.237 28.355 -18.437 1.00 23.13 N ATOM 1452 CA PRO A 541 -1.191 29.597 -17.637 1.00 23.17 C ATOM 1453 C PRO A 541 -2.518 30.048 -17.017 1.00 26.70 C ATOM 1454 O PRO A 541 -2.498 30.477 -15.870 1.00 26.14 O ATOM 1455 CB PRO A 541 -0.637 30.627 -18.626 1.00 24.73 C ATOM 1456 CG PRO A 541 0.167 29.815 -19.591 1.00 28.92 C ATOM 1457 CD PRO A 541 -0.699 28.597 -19.793 1.00 24.50 C ATOM 0 HA PRO A 541 -0.648 29.469 -16.843 1.00 23.17 H new ATOM 0 HB2 PRO A 541 -1.351 31.106 -19.075 1.00 24.73 H new ATOM 0 HB3 PRO A 541 -0.089 31.290 -18.177 1.00 24.73 H new ATOM 0 HG2 PRO A 541 0.321 30.290 -20.422 1.00 28.92 H new ATOM 0 HG3 PRO A 541 1.037 29.584 -19.231 1.00 28.92 H new ATOM 0 HD2 PRO A 541 -1.405 28.760 -20.438 1.00 24.50 H new ATOM 0 HD3 PRO A 541 -0.187 27.840 -20.118 1.00 24.50 H new ATOM 1458 N GLU A 542 -3.662 29.884 -17.721 1.00 24.00 N ATOM 1459 CA GLU A 542 -4.998 30.206 -17.161 1.00 24.21 C ATOM 1460 C GLU A 542 -5.343 29.298 -15.947 1.00 28.22 C ATOM 1461 O GLU A 542 -6.119 29.721 -15.090 1.00 28.42 O ATOM 1462 CB GLU A 542 -6.110 30.135 -18.233 1.00 25.10 C ATOM 1463 CG GLU A 542 -6.447 28.731 -18.732 1.00 29.59 C ATOM 1464 CD GLU A 542 -5.618 28.186 -19.880 1.00 36.67 C ATOM 1465 OE1 GLU A 542 -4.586 28.802 -20.239 1.00 28.70 O ATOM 1466 OE2 GLU A 542 -6.005 27.126 -20.423 1.00 25.34 O1- ATOM 0 H GLU A 542 -3.684 29.586 -18.528 1.00 24.00 H new ATOM 0 HA GLU A 542 -4.954 31.123 -16.847 1.00 24.21 H new ATOM 0 HB2 GLU A 542 -6.915 30.535 -17.869 1.00 25.10 H new ATOM 0 HB3 GLU A 542 -5.842 30.676 -18.992 1.00 25.10 H new ATOM 0 HG2 GLU A 542 -6.365 28.118 -17.984 1.00 29.59 H new ATOM 0 HG3 GLU A 542 -7.378 28.724 -19.004 1.00 29.59 H new ATOM 1467 N CYS A 543 -4.746 28.066 -15.861 1.00 23.47 N ATOM 1468 CA CYS A 543 -4.976 27.145 -14.725 1.00 22.76 C ATOM 1469 C CYS A 543 -4.264 27.673 -13.491 1.00 28.19 C ATOM 1470 O CYS A 543 -4.822 27.658 -12.394 1.00 28.04 O ATOM 1471 CB CYS A 543 -4.526 25.718 -15.045 1.00 22.30 C ATOM 1472 SG CYS A 543 -5.212 25.047 -16.582 1.00 26.54 S ATOM 0 H CYS A 543 -4.207 27.758 -16.456 1.00 23.47 H new ATOM 0 HA CYS A 543 -5.930 27.107 -14.554 1.00 22.76 H new ATOM 0 HB2 CYS A 543 -3.558 25.700 -15.100 1.00 22.30 H new ATOM 0 HB3 CYS A 543 -4.779 25.138 -14.310 1.00 22.30 H new ATOM 0 HG CYS A 543 -6.032 24.210 -16.323 1.00 26.54 H new ATOM 1473 N ILE A 544 -3.003 28.091 -13.668 1.00 26.40 N ATOM 1474 CA ILE A 544 -2.160 28.628 -12.592 1.00 27.41 C ATOM 1475 C ILE A 544 -2.651 30.022 -12.179 1.00 30.70 C ATOM 1476 O ILE A 544 -2.754 30.293 -10.989 1.00 30.93 O ATOM 1477 CB ILE A 544 -0.636 28.628 -13.009 1.00 30.50 C ATOM 1478 CG1 ILE A 544 -0.138 27.200 -13.432 1.00 30.21 C ATOM 1479 CG2 ILE A 544 0.280 29.243 -11.916 1.00 31.18 C ATOM 1480 CD1 ILE A 544 -0.413 26.036 -12.331 1.00 28.09 C ATOM 0 H ILE A 544 -2.608 28.069 -14.432 1.00 26.40 H new ATOM 0 HA ILE A 544 -2.235 28.050 -11.817 1.00 27.41 H new ATOM 0 HB ILE A 544 -0.572 29.201 -13.789 1.00 30.50 H new ATOM 0 HG12 ILE A 544 -0.572 26.952 -14.263 1.00 30.21 H new ATOM 0 HG13 ILE A 544 0.815 27.242 -13.611 1.00 30.21 H new ATOM 0 HG21 ILE A 544 1.202 29.221 -12.216 1.00 31.18 H new ATOM 0 HG22 ILE A 544 0.016 30.162 -11.751 1.00 31.18 H new ATOM 0 HG23 ILE A 544 0.195 28.731 -11.097 1.00 31.18 H new ATOM 0 HD11 ILE A 544 -0.079 25.189 -12.665 1.00 28.09 H new ATOM 0 HD12 ILE A 544 0.041 26.259 -11.504 1.00 28.09 H new ATOM 0 HD13 ILE A 544 -1.366 25.964 -12.167 1.00 28.09 H new ATOM 1481 N ASN A 545 -2.968 30.880 -13.153 1.00 28.09 N ATOM 1482 CA ASN A 545 -3.355 32.276 -12.895 1.00 28.82 C ATOM 1483 C ASN A 545 -4.810 32.526 -12.507 1.00 32.99 C ATOM 1484 O ASN A 545 -5.068 33.468 -11.749 1.00 32.30 O ATOM 1485 CB ASN A 545 -2.981 33.171 -14.095 1.00 27.92 C ATOM 1486 CG ASN A 545 -1.491 33.270 -14.362 1.00 37.53 C ATOM 1487 OD1 ASN A 545 -0.655 33.161 -13.467 1.00 30.39 O ATOM 1488 ND2 ASN A 545 -1.128 33.494 -15.601 1.00 32.26 N ATOM 0 H ASN A 545 -2.965 30.669 -13.987 1.00 28.09 H new ATOM 0 HA ASN A 545 -2.847 32.508 -12.102 1.00 28.82 H new ATOM 0 HB2 ASN A 545 -3.419 32.828 -14.890 1.00 27.92 H new ATOM 0 HB3 ASN A 545 -3.331 34.062 -13.941 1.00 27.92 H new ATOM 0 HD21 ASN A 545 -0.294 33.567 -15.798 1.00 32.26 H new ATOM 0 HD22 ASN A 545 -1.724 33.568 -16.217 1.00 32.26 H new ATOM 1489 N TYR A 546 -5.755 31.752 -13.072 1.00 29.13 N ATOM 1490 CA TYR A 546 -7.202 31.950 -12.857 1.00 29.27 C ATOM 1491 C TYR A 546 -7.969 30.719 -12.306 1.00 31.04 C ATOM 1492 O TYR A 546 -9.192 30.794 -12.124 1.00 28.17 O ATOM 1493 CB TYR A 546 -7.858 32.428 -14.168 1.00 31.16 C ATOM 1494 CG TYR A 546 -7.297 33.733 -14.699 1.00 34.25 C ATOM 1495 CD1 TYR A 546 -6.337 33.745 -15.707 1.00 35.85 C ATOM 1496 CD2 TYR A 546 -7.757 34.959 -14.219 1.00 35.46 C ATOM 1497 CE1 TYR A 546 -5.831 34.943 -16.212 1.00 35.69 C ATOM 1498 CE2 TYR A 546 -7.259 36.165 -14.719 1.00 36.37 C ATOM 1499 CZ TYR A 546 -6.285 36.152 -15.706 1.00 42.18 C ATOM 1500 OH TYR A 546 -5.781 37.339 -16.188 1.00 40.37 O ATOM 0 H TYR A 546 -5.572 31.094 -13.594 1.00 29.13 H new ATOM 0 HA TYR A 546 -7.268 32.622 -12.160 1.00 29.27 H new ATOM 0 HB2 TYR A 546 -7.747 31.741 -14.843 1.00 31.16 H new ATOM 0 HB3 TYR A 546 -8.811 32.532 -14.023 1.00 31.16 H new ATOM 0 HD1 TYR A 546 -6.027 32.938 -16.051 1.00 35.85 H new ATOM 0 HD2 TYR A 546 -8.407 34.974 -13.554 1.00 35.46 H new ATOM 0 HE1 TYR A 546 -5.191 34.931 -16.886 1.00 35.69 H new ATOM 0 HE2 TYR A 546 -7.580 36.974 -14.391 1.00 36.37 H new ATOM 0 HH TYR A 546 -6.148 37.982 -15.791 1.00 40.37 H new ATOM 1501 N TYR A 547 -7.271 29.579 -12.085 1.00 28.15 N ATOM 1502 CA TYR A 547 -7.867 28.311 -11.608 1.00 28.08 C ATOM 1503 C TYR A 547 -8.968 27.801 -12.554 1.00 29.98 C ATOM 1504 O TYR A 547 -9.873 27.097 -12.113 1.00 29.15 O ATOM 1505 CB TYR A 547 -8.408 28.422 -10.158 1.00 31.36 C ATOM 1506 CG TYR A 547 -7.427 28.821 -9.076 1.00 36.90 C ATOM 1507 CD1 TYR A 547 -6.051 28.749 -9.287 1.00 39.23 C ATOM 1508 CD2 TYR A 547 -7.872 29.197 -7.811 1.00 39.37 C ATOM 1509 CE1 TYR A 547 -5.145 29.109 -8.289 1.00 40.96 C ATOM 1510 CE2 TYR A 547 -6.976 29.549 -6.802 1.00 41.21 C ATOM 1511 CZ TYR A 547 -5.612 29.500 -7.045 1.00 50.99 C ATOM 1512 OH TYR A 547 -4.726 29.841 -6.052 1.00 54.42 O ATOM 0 H TYR A 547 -6.422 29.525 -12.212 1.00 28.15 H new ATOM 0 HA TYR A 547 -7.147 27.661 -11.605 1.00 28.08 H new ATOM 0 HB2 TYR A 547 -9.133 29.066 -10.157 1.00 31.36 H new ATOM 0 HB3 TYR A 547 -8.790 27.564 -9.914 1.00 31.36 H new ATOM 0 HD1 TYR A 547 -5.731 28.455 -10.109 1.00 39.23 H new ATOM 0 HD2 TYR A 547 -8.785 29.214 -7.636 1.00 39.37 H new ATOM 0 HE1 TYR A 547 -4.231 29.087 -8.458 1.00 40.96 H new ATOM 0 HE2 TYR A 547 -7.292 29.816 -5.969 1.00 41.21 H new ATOM 0 HH TYR A 547 -5.150 30.056 -5.360 1.00 54.42 H new ATOM 1513 N LYS A 548 -8.896 28.174 -13.854 1.00 25.72 N ATOM 1514 CA LYS A 548 -9.879 27.798 -14.864 1.00 25.57 C ATOM 1515 C LYS A 548 -9.375 26.642 -15.727 1.00 28.23 C ATOM 1516 O LYS A 548 -8.286 26.730 -16.305 1.00 27.65 O ATOM 1517 CB LYS A 548 -10.245 29.014 -15.738 1.00 28.31 C ATOM 1518 CG LYS A 548 -11.092 30.070 -15.004 1.00 30.85 C ATOM 1519 CD LYS A 548 -11.196 31.385 -15.791 1.00 32.29 C ATOM 1520 CE LYS A 548 -12.095 31.293 -17.012 1.00 45.98 C ATOM 1521 NZ LYS A 548 -12.567 32.629 -17.471 1.00 59.05 N ATOM 0 H LYS A 548 -8.258 28.661 -14.164 1.00 25.72 H new ATOM 0 HA LYS A 548 -10.679 27.495 -14.406 1.00 25.57 H new ATOM 0 HB2 LYS A 548 -9.429 29.430 -16.057 1.00 28.31 H new ATOM 0 HB3 LYS A 548 -10.731 28.707 -16.519 1.00 28.31 H new ATOM 0 HG2 LYS A 548 -11.982 29.717 -14.849 1.00 30.85 H new ATOM 0 HG3 LYS A 548 -10.702 30.247 -14.134 1.00 30.85 H new ATOM 0 HD2 LYS A 548 -11.532 32.079 -15.203 1.00 32.29 H new ATOM 0 HD3 LYS A 548 -10.308 31.656 -16.072 1.00 32.29 H new ATOM 0 HE2 LYS A 548 -11.614 30.858 -17.733 1.00 45.98 H new ATOM 0 HE3 LYS A 548 -12.861 30.735 -16.805 1.00 45.98 H new ATOM 0 HZ1 LYS A 548 -12.860 32.569 -18.309 1.00 59.05 H new ATOM 0 HZ2 LYS A 548 -13.229 32.907 -16.945 1.00 59.05 H new ATOM 0 HZ3 LYS A 548 -11.894 33.211 -17.434 1.00 59.05 H new ATOM 1522 N PHE A 549 -10.186 25.580 -15.845 1.00 23.71 N ATOM 1523 CA PHE A 549 -9.804 24.374 -16.589 1.00 21.97 C ATOM 1524 C PHE A 549 -10.820 24.089 -17.695 1.00 24.98 C ATOM 1525 O PHE A 549 -11.982 23.894 -17.414 1.00 23.48 O ATOM 1526 CB PHE A 549 -9.714 23.186 -15.608 1.00 22.92 C ATOM 1527 CG PHE A 549 -8.661 23.348 -14.533 1.00 23.78 C ATOM 1528 CD1 PHE A 549 -8.936 24.047 -13.361 1.00 25.12 C ATOM 1529 CD2 PHE A 549 -7.395 22.804 -14.693 1.00 23.51 C ATOM 1530 CE1 PHE A 549 -7.952 24.215 -12.380 1.00 25.57 C ATOM 1531 CE2 PHE A 549 -6.418 22.963 -13.708 1.00 26.25 C ATOM 1532 CZ PHE A 549 -6.707 23.654 -12.550 1.00 24.28 C ATOM 0 H PHE A 549 -10.971 25.541 -15.496 1.00 23.71 H new ATOM 0 HA PHE A 549 -8.939 24.508 -17.007 1.00 21.97 H new ATOM 0 HB2 PHE A 549 -10.578 23.063 -15.184 1.00 22.92 H new ATOM 0 HB3 PHE A 549 -9.527 22.378 -16.111 1.00 22.92 H new ATOM 0 HD1 PHE A 549 -9.783 24.407 -13.228 1.00 25.12 H new ATOM 0 HD2 PHE A 549 -7.194 22.327 -15.466 1.00 23.51 H new ATOM 0 HE1 PHE A 549 -8.140 24.706 -11.613 1.00 25.57 H new ATOM 0 HE2 PHE A 549 -5.570 22.602 -13.833 1.00 26.25 H new ATOM 0 HZ PHE A 549 -6.062 23.741 -11.886 1.00 24.28 H new ATOM 1533 N SER A 550 -10.377 24.073 -18.942 1.00 22.72 N ATOM 1534 CA SER A 550 -11.221 23.792 -20.106 1.00 22.49 C ATOM 1535 C SER A 550 -10.586 22.666 -20.925 1.00 25.49 C ATOM 1536 O SER A 550 -9.511 22.196 -20.570 1.00 23.92 O ATOM 1537 CB SER A 550 -11.338 25.053 -20.966 1.00 24.32 C ATOM 1538 OG SER A 550 -10.044 25.508 -21.338 1.00 27.30 O ATOM 0 H SER A 550 -9.556 24.229 -19.146 1.00 22.72 H new ATOM 0 HA SER A 550 -12.105 23.521 -19.814 1.00 22.49 H new ATOM 0 HB2 SER A 550 -11.864 24.865 -21.759 1.00 24.32 H new ATOM 0 HB3 SER A 550 -11.804 25.747 -20.474 1.00 24.32 H new ATOM 0 HG SER A 550 -9.768 26.062 -20.770 1.00 27.30 H new ATOM 1539 N SER A 551 -11.215 22.251 -22.035 1.00 22.30 N ATOM 1540 CA SER A 551 -10.594 21.253 -22.891 1.00 21.85 C ATOM 1541 C SER A 551 -9.308 21.834 -23.534 1.00 26.35 C ATOM 1542 O SER A 551 -8.353 21.077 -23.748 1.00 22.85 O ATOM 1543 CB SER A 551 -11.569 20.742 -23.943 1.00 22.31 C ATOM 1544 OG SER A 551 -12.528 19.903 -23.320 1.00 24.93 O ATOM 0 H SER A 551 -11.984 22.532 -22.298 1.00 22.30 H new ATOM 0 HA SER A 551 -10.343 20.490 -22.347 1.00 21.85 H new ATOM 0 HB2 SER A 551 -12.010 21.487 -24.380 1.00 22.31 H new ATOM 0 HB3 SER A 551 -11.092 20.252 -24.631 1.00 22.31 H new ATOM 0 HG SER A 551 -12.152 19.205 -23.042 1.00 24.93 H new ATOM 1545 N LYS A 552 -9.265 23.189 -23.770 1.00 22.61 N ATOM 1546 CA LYS A 552 -8.067 23.892 -24.282 1.00 22.21 C ATOM 1547 C LYS A 552 -6.920 23.811 -23.269 1.00 24.53 C ATOM 1548 O LYS A 552 -5.769 23.702 -23.670 1.00 23.71 O ATOM 1549 CB LYS A 552 -8.331 25.368 -24.618 1.00 24.82 C ATOM 1550 CG LYS A 552 -9.448 25.675 -25.611 1.00 34.54 C ATOM 1551 CD LYS A 552 -9.110 25.367 -27.056 1.00 43.87 C ATOM 1552 CE LYS A 552 -10.074 26.051 -28.003 1.00 42.55 C ATOM 1553 NZ LYS A 552 -9.730 27.484 -28.195 1.00 46.85 N ATOM 0 H LYS A 552 -9.936 23.709 -23.633 1.00 22.61 H new ATOM 0 HA LYS A 552 -7.824 23.440 -25.105 1.00 22.21 H new ATOM 0 HB2 LYS A 552 -8.530 25.833 -23.790 1.00 24.82 H new ATOM 0 HB3 LYS A 552 -7.509 25.748 -24.965 1.00 24.82 H new ATOM 0 HG2 LYS A 552 -10.236 25.168 -25.360 1.00 34.54 H new ATOM 0 HG3 LYS A 552 -9.680 26.614 -25.539 1.00 34.54 H new ATOM 0 HD2 LYS A 552 -8.204 25.657 -27.248 1.00 43.87 H new ATOM 0 HD3 LYS A 552 -9.137 24.408 -27.200 1.00 43.87 H new ATOM 0 HE2 LYS A 552 -10.063 25.597 -28.860 1.00 42.55 H new ATOM 0 HE3 LYS A 552 -10.977 25.978 -27.655 1.00 42.55 H new ATOM 0 HZ1 LYS A 552 -10.330 27.864 -28.732 1.00 46.85 H new ATOM 0 HZ2 LYS A 552 -9.733 27.898 -27.407 1.00 46.85 H new ATOM 0 HZ3 LYS A 552 -8.921 27.549 -28.561 1.00 46.85 H new ATOM 1554 N SER A 553 -7.225 23.849 -21.955 1.00 21.13 N ATOM 1555 CA SER A 553 -6.236 23.648 -20.884 1.00 20.56 C ATOM 1556 C SER A 553 -5.648 22.215 -21.023 1.00 24.34 C ATOM 1557 O SER A 553 -4.435 22.031 -20.873 1.00 24.86 O ATOM 1558 CB SER A 553 -6.900 23.787 -19.511 1.00 22.50 C ATOM 1559 OG SER A 553 -7.572 25.034 -19.398 1.00 29.28 O ATOM 0 H SER A 553 -8.021 23.994 -21.664 1.00 21.13 H new ATOM 0 HA SER A 553 -5.536 24.315 -20.960 1.00 20.56 H new ATOM 0 HB2 SER A 553 -7.530 23.062 -19.377 1.00 22.50 H new ATOM 0 HB3 SER A 553 -6.230 23.712 -18.814 1.00 22.50 H new ATOM 0 HG SER A 553 -7.080 25.646 -19.696 1.00 29.28 H new ATOM 1560 N ASP A 554 -6.502 21.220 -21.362 1.00 18.96 N ATOM 1561 CA ASP A 554 -6.040 19.850 -21.571 1.00 18.97 C ATOM 1562 C ASP A 554 -5.163 19.766 -22.824 1.00 22.00 C ATOM 1563 O ASP A 554 -4.266 18.919 -22.860 1.00 21.69 O ATOM 1564 CB ASP A 554 -7.206 18.840 -21.671 1.00 19.77 C ATOM 1565 CG ASP A 554 -7.913 18.428 -20.392 1.00 22.92 C ATOM 1566 OD1 ASP A 554 -7.260 18.459 -19.299 1.00 21.22 O ATOM 1567 OD2 ASP A 554 -9.098 17.992 -20.483 1.00 23.63 O1- ATOM 0 H ASP A 554 -7.348 21.330 -21.472 1.00 18.96 H new ATOM 0 HA ASP A 554 -5.515 19.608 -20.792 1.00 18.97 H new ATOM 0 HB2 ASP A 554 -7.871 19.214 -22.269 1.00 19.77 H new ATOM 0 HB3 ASP A 554 -6.865 18.036 -22.093 1.00 19.77 H new ATOM 1568 N VAL A 555 -5.413 20.630 -23.847 1.00 19.27 N ATOM 1569 CA VAL A 555 -4.547 20.664 -25.056 1.00 19.13 C ATOM 1570 C VAL A 555 -3.105 21.077 -24.640 1.00 22.76 C ATOM 1571 O VAL A 555 -2.141 20.517 -25.157 1.00 21.84 O ATOM 1572 CB VAL A 555 -5.104 21.575 -26.184 1.00 22.88 C ATOM 1573 CG1 VAL A 555 -4.058 21.824 -27.296 1.00 21.51 C ATOM 1574 CG2 VAL A 555 -6.368 20.981 -26.779 1.00 22.89 C ATOM 0 H VAL A 555 -6.065 21.191 -23.857 1.00 19.27 H new ATOM 0 HA VAL A 555 -4.532 19.772 -25.437 1.00 19.13 H new ATOM 0 HB VAL A 555 -5.316 22.431 -25.781 1.00 22.88 H new ATOM 0 HG11 VAL A 555 -4.442 22.395 -27.980 1.00 21.51 H new ATOM 0 HG12 VAL A 555 -3.277 22.256 -26.915 1.00 21.51 H new ATOM 0 HG13 VAL A 555 -3.798 20.977 -27.691 1.00 21.51 H new ATOM 0 HG21 VAL A 555 -6.700 21.563 -27.480 1.00 22.89 H new ATOM 0 HG22 VAL A 555 -6.171 20.107 -27.151 1.00 22.89 H new ATOM 0 HG23 VAL A 555 -7.041 20.893 -26.086 1.00 22.89 H new ATOM 1575 N TRP A 556 -2.974 22.060 -23.723 1.00 19.21 N ATOM 1576 CA TRP A 556 -1.665 22.477 -23.231 1.00 19.04 C ATOM 1577 C TRP A 556 -0.936 21.259 -22.644 1.00 21.72 C ATOM 1578 O TRP A 556 0.215 20.991 -23.043 1.00 20.52 O ATOM 1579 CB TRP A 556 -1.777 23.610 -22.200 1.00 18.31 C ATOM 1580 CG TRP A 556 -0.440 24.053 -21.662 1.00 19.84 C ATOM 1581 CD1 TRP A 556 0.382 23.356 -20.820 1.00 22.17 C ATOM 1582 CD2 TRP A 556 0.251 25.277 -21.982 1.00 20.06 C ATOM 1583 NE1 TRP A 556 1.538 24.069 -20.591 1.00 22.43 N ATOM 1584 CE2 TRP A 556 1.476 25.261 -21.275 1.00 23.66 C ATOM 1585 CE3 TRP A 556 -0.069 26.406 -22.767 1.00 21.39 C ATOM 1586 CZ2 TRP A 556 2.400 26.312 -21.352 1.00 23.02 C ATOM 1587 CZ3 TRP A 556 0.841 27.458 -22.828 1.00 22.64 C ATOM 1588 CH2 TRP A 556 2.051 27.412 -22.114 1.00 23.22 C ATOM 0 H TRP A 556 -3.636 22.490 -23.381 1.00 19.21 H new ATOM 0 HA TRP A 556 -1.151 22.831 -23.974 1.00 19.04 H new ATOM 0 HB2 TRP A 556 -2.223 24.369 -22.608 1.00 18.31 H new ATOM 0 HB3 TRP A 556 -2.335 23.316 -21.463 1.00 18.31 H new ATOM 0 HD1 TRP A 556 0.189 22.523 -20.455 1.00 22.17 H new ATOM 0 HE1 TRP A 556 2.194 23.810 -20.099 1.00 22.43 H new ATOM 0 HE3 TRP A 556 -0.872 26.446 -23.234 1.00 21.39 H new ATOM 0 HZ2 TRP A 556 3.216 26.271 -20.908 1.00 23.02 H new ATOM 0 HZ3 TRP A 556 0.645 28.203 -23.349 1.00 22.64 H new ATOM 0 HH2 TRP A 556 2.630 28.138 -22.155 1.00 23.22 H new ATOM 1589 N SER A 557 -1.623 20.495 -21.741 1.00 16.78 N ATOM 1590 CA SER A 557 -1.067 19.275 -21.118 1.00 17.23 C ATOM 1591 C SER A 557 -0.629 18.259 -22.159 1.00 20.46 C ATOM 1592 O SER A 557 0.422 17.627 -21.982 1.00 20.35 O ATOM 1593 CB SER A 557 -2.071 18.630 -20.161 1.00 19.24 C ATOM 1594 OG SER A 557 -2.597 19.595 -19.260 1.00 23.35 O ATOM 0 H SER A 557 -2.422 20.680 -21.482 1.00 16.78 H new ATOM 0 HA SER A 557 -0.287 19.553 -20.614 1.00 17.23 H new ATOM 0 HB2 SER A 557 -2.793 18.225 -20.667 1.00 19.24 H new ATOM 0 HB3 SER A 557 -1.639 17.918 -19.664 1.00 19.24 H new ATOM 0 HG SER A 557 -1.966 20.017 -18.901 1.00 23.35 H new ATOM 1595 N PHE A 558 -1.435 18.105 -23.230 1.00 16.50 N ATOM 1596 CA PHE A 558 -1.157 17.190 -24.353 1.00 17.71 C ATOM 1597 C PHE A 558 0.174 17.560 -25.042 1.00 22.34 C ATOM 1598 O PHE A 558 0.882 16.660 -25.512 1.00 22.42 O ATOM 1599 CB PHE A 558 -2.327 17.164 -25.363 1.00 18.58 C ATOM 1600 CG PHE A 558 -2.106 16.208 -26.515 1.00 19.42 C ATOM 1601 CD1 PHE A 558 -2.244 14.832 -26.338 1.00 22.36 C ATOM 1602 CD2 PHE A 558 -1.697 16.675 -27.760 1.00 20.61 C ATOM 1603 CE1 PHE A 558 -2.010 13.944 -27.396 1.00 23.41 C ATOM 1604 CE2 PHE A 558 -1.466 15.781 -28.821 1.00 22.91 C ATOM 1605 CZ PHE A 558 -1.631 14.428 -28.635 1.00 21.29 C ATOM 0 H PHE A 558 -2.171 18.539 -23.322 1.00 16.50 H new ATOM 0 HA PHE A 558 -1.069 16.294 -23.993 1.00 17.71 H new ATOM 0 HB2 PHE A 558 -3.141 16.916 -24.898 1.00 18.58 H new ATOM 0 HB3 PHE A 558 -2.462 18.058 -25.715 1.00 18.58 H new ATOM 0 HD1 PHE A 558 -2.495 14.499 -25.507 1.00 22.36 H new ATOM 0 HD2 PHE A 558 -1.575 17.587 -27.892 1.00 20.61 H new ATOM 0 HE1 PHE A 558 -2.110 13.029 -27.265 1.00 23.41 H new ATOM 0 HE2 PHE A 558 -1.201 16.106 -29.651 1.00 22.91 H new ATOM 0 HZ PHE A 558 -1.488 13.840 -29.341 1.00 21.29 H new ATOM 1606 N GLY A 559 0.487 18.868 -25.100 1.00 18.63 N ATOM 1607 CA GLY A 559 1.748 19.352 -25.665 1.00 17.40 C ATOM 1608 C GLY A 559 2.910 18.843 -24.838 1.00 19.43 C ATOM 1609 O GLY A 559 3.900 18.336 -25.377 1.00 18.40 O ATOM 0 H GLY A 559 -0.029 19.493 -24.812 1.00 18.63 H new ATOM 0 HA2 GLY A 559 1.837 19.051 -26.583 1.00 17.40 H new ATOM 0 HA3 GLY A 559 1.753 20.322 -25.683 1.00 17.40 H new ATOM 1610 N VAL A 560 2.766 18.918 -23.500 1.00 16.15 N ATOM 1611 CA VAL A 560 3.784 18.425 -22.563 1.00 16.88 C ATOM 1612 C VAL A 560 3.922 16.909 -22.700 1.00 21.27 C ATOM 1613 O VAL A 560 5.040 16.393 -22.695 1.00 21.08 O ATOM 1614 CB VAL A 560 3.499 18.844 -21.084 1.00 19.88 C ATOM 1615 CG1 VAL A 560 4.595 18.318 -20.162 1.00 19.92 C ATOM 1616 CG2 VAL A 560 3.391 20.371 -20.953 1.00 19.31 C ATOM 0 H VAL A 560 2.075 19.256 -23.117 1.00 16.15 H new ATOM 0 HA VAL A 560 4.628 18.842 -22.798 1.00 16.88 H new ATOM 0 HB VAL A 560 2.650 18.454 -20.822 1.00 19.88 H new ATOM 0 HG11 VAL A 560 4.406 18.585 -19.249 1.00 19.92 H new ATOM 0 HG12 VAL A 560 4.626 17.350 -20.216 1.00 19.92 H new ATOM 0 HG13 VAL A 560 5.451 18.684 -20.435 1.00 19.92 H new ATOM 0 HG21 VAL A 560 3.214 20.605 -20.028 1.00 19.31 H new ATOM 0 HG22 VAL A 560 4.224 20.780 -21.236 1.00 19.31 H new ATOM 0 HG23 VAL A 560 2.667 20.693 -21.512 1.00 19.31 H new ATOM 1617 N LEU A 561 2.785 16.202 -22.844 1.00 19.01 N ATOM 1618 CA LEU A 561 2.749 14.742 -23.012 1.00 19.51 C ATOM 1619 C LEU A 561 3.525 14.331 -24.288 1.00 20.76 C ATOM 1620 O LEU A 561 4.299 13.365 -24.258 1.00 18.34 O ATOM 1621 CB LEU A 561 1.273 14.293 -23.063 1.00 19.94 C ATOM 1622 CG LEU A 561 0.972 12.789 -23.096 1.00 24.55 C ATOM 1623 CD1 LEU A 561 -0.485 12.543 -22.693 1.00 24.75 C ATOM 1624 CD2 LEU A 561 1.166 12.211 -24.485 1.00 24.48 C ATOM 0 H LEU A 561 2.006 16.566 -22.846 1.00 19.01 H new ATOM 0 HA LEU A 561 3.183 14.302 -22.264 1.00 19.51 H new ATOM 0 HB2 LEU A 561 0.823 14.668 -22.290 1.00 19.94 H new ATOM 0 HB3 LEU A 561 0.869 14.693 -23.849 1.00 19.94 H new ATOM 0 HG LEU A 561 1.585 12.360 -22.479 1.00 24.55 H new ATOM 0 HD11 LEU A 561 -0.671 11.591 -22.715 1.00 24.75 H new ATOM 0 HD12 LEU A 561 -0.634 12.880 -21.796 1.00 24.75 H new ATOM 0 HD13 LEU A 561 -1.074 13.002 -23.312 1.00 24.75 H new ATOM 0 HD21 LEU A 561 0.968 11.261 -24.471 1.00 24.48 H new ATOM 0 HD22 LEU A 561 0.570 12.656 -25.107 1.00 24.48 H new ATOM 0 HD23 LEU A 561 2.085 12.345 -24.766 1.00 24.48 H new ATOM 1625 N MET A 562 3.302 15.056 -25.399 1.00 18.07 N ATOM 1626 CA MET A 562 4.031 14.831 -26.657 1.00 18.71 C ATOM 1627 C MET A 562 5.534 14.973 -26.443 1.00 21.20 C ATOM 1628 O MET A 562 6.292 14.110 -26.891 1.00 19.76 O ATOM 1629 CB MET A 562 3.572 15.797 -27.743 1.00 21.65 C ATOM 1630 CG MET A 562 2.296 15.369 -28.427 1.00 26.64 C ATOM 1631 SD MET A 562 1.800 16.585 -29.679 1.00 33.43 S ATOM 1632 CE MET A 562 2.916 16.139 -31.042 1.00 31.50 C ATOM 0 H MET A 562 2.723 15.691 -25.441 1.00 18.07 H new ATOM 0 HA MET A 562 3.837 13.926 -26.948 1.00 18.71 H new ATOM 0 HB2 MET A 562 3.442 16.675 -27.352 1.00 21.65 H new ATOM 0 HB3 MET A 562 4.274 15.883 -28.407 1.00 21.65 H new ATOM 0 HG2 MET A 562 2.422 14.502 -28.844 1.00 26.64 H new ATOM 0 HG3 MET A 562 1.590 15.268 -27.770 1.00 26.64 H new ATOM 0 HE1 MET A 562 3.302 16.944 -31.421 1.00 31.50 H new ATOM 0 HE2 MET A 562 3.625 15.568 -30.707 1.00 31.50 H new ATOM 0 HE3 MET A 562 2.418 15.667 -31.727 1.00 31.50 H new ATOM 1633 N TRP A 563 5.963 16.035 -25.733 1.00 19.65 N ATOM 1634 CA TRP A 563 7.367 16.280 -25.406 1.00 19.49 C ATOM 1635 C TRP A 563 7.952 15.082 -24.655 1.00 21.59 C ATOM 1636 O TRP A 563 9.029 14.617 -25.005 1.00 20.22 O ATOM 1637 CB TRP A 563 7.562 17.593 -24.599 1.00 18.36 C ATOM 1638 CG TRP A 563 9.008 17.952 -24.408 1.00 19.61 C ATOM 1639 CD1 TRP A 563 9.787 18.695 -25.252 1.00 22.26 C ATOM 1640 CD2 TRP A 563 9.882 17.458 -23.389 1.00 19.92 C ATOM 1641 NE1 TRP A 563 11.087 18.718 -24.798 1.00 21.13 N ATOM 1642 CE2 TRP A 563 11.169 17.984 -23.648 1.00 23.64 C ATOM 1643 CE3 TRP A 563 9.697 16.644 -22.257 1.00 21.48 C ATOM 1644 CZ2 TRP A 563 12.266 17.706 -22.829 1.00 24.01 C ATOM 1645 CZ3 TRP A 563 10.799 16.323 -21.481 1.00 23.73 C ATOM 1646 CH2 TRP A 563 12.055 16.882 -21.742 1.00 24.34 C ATOM 0 H TRP A 563 5.431 16.637 -25.427 1.00 19.65 H new ATOM 0 HA TRP A 563 7.847 16.392 -26.241 1.00 19.49 H new ATOM 0 HB2 TRP A 563 7.111 18.319 -25.058 1.00 18.36 H new ATOM 0 HB3 TRP A 563 7.139 17.500 -23.731 1.00 18.36 H new ATOM 0 HD1 TRP A 563 9.483 19.122 -26.020 1.00 22.26 H new ATOM 0 HE1 TRP A 563 11.741 19.128 -25.177 1.00 21.13 H new ATOM 0 HE3 TRP A 563 8.852 16.327 -22.034 1.00 21.48 H new ATOM 0 HZ2 TRP A 563 13.106 18.062 -23.009 1.00 24.01 H new ATOM 0 HZ3 TRP A 563 10.702 15.726 -20.775 1.00 23.73 H new ATOM 0 HH2 TRP A 563 12.764 16.694 -21.170 1.00 24.34 H new ATOM 1647 N GLU A 564 7.240 14.582 -23.634 1.00 17.95 N ATOM 1648 CA GLU A 564 7.673 13.434 -22.820 1.00 17.62 C ATOM 1649 C GLU A 564 7.872 12.171 -23.667 1.00 21.81 C ATOM 1650 O GLU A 564 8.865 11.459 -23.483 1.00 19.99 O ATOM 1651 CB GLU A 564 6.617 13.131 -21.751 1.00 18.75 C ATOM 1652 CG GLU A 564 6.453 14.171 -20.657 1.00 23.19 C ATOM 1653 CD GLU A 564 5.414 13.712 -19.649 1.00 25.30 C ATOM 1654 OE1 GLU A 564 4.198 13.923 -19.878 1.00 18.86 O ATOM 1655 OE2 GLU A 564 5.813 13.034 -18.679 1.00 24.25 O1- ATOM 0 H GLU A 564 6.481 14.906 -23.392 1.00 17.95 H new ATOM 0 HA GLU A 564 8.521 13.674 -22.415 1.00 17.62 H new ATOM 0 HB2 GLU A 564 5.761 13.015 -22.192 1.00 18.75 H new ATOM 0 HB3 GLU A 564 6.839 12.283 -21.335 1.00 18.75 H new ATOM 0 HG2 GLU A 564 7.302 14.319 -20.212 1.00 23.19 H new ATOM 0 HG3 GLU A 564 6.185 15.019 -21.045 1.00 23.19 H new ATOM 1656 N ALA A 565 6.928 11.921 -24.600 1.00 20.09 N ATOM 1657 CA ALA A 565 6.908 10.750 -25.495 1.00 20.27 C ATOM 1658 C ALA A 565 8.055 10.769 -26.494 1.00 24.15 C ATOM 1659 O ALA A 565 8.676 9.727 -26.722 1.00 24.58 O ATOM 1660 CB ALA A 565 5.573 10.660 -26.223 1.00 20.52 C ATOM 0 H ALA A 565 6.262 12.449 -24.729 1.00 20.09 H new ATOM 0 HA ALA A 565 7.023 9.963 -24.940 1.00 20.27 H new ATOM 0 HB1 ALA A 565 5.574 9.886 -26.807 1.00 20.52 H new ATOM 0 HB2 ALA A 565 4.856 10.574 -25.575 1.00 20.52 H new ATOM 0 HB3 ALA A 565 5.437 11.463 -26.751 1.00 20.52 H new ATOM 1661 N PHE A 566 8.343 11.935 -27.087 1.00 20.98 N ATOM 1662 CA PHE A 566 9.467 12.067 -28.014 1.00 21.57 C ATOM 1663 C PHE A 566 10.818 12.135 -27.289 1.00 27.29 C ATOM 1664 O PHE A 566 11.861 11.963 -27.927 1.00 28.42 O ATOM 1665 CB PHE A 566 9.256 13.213 -29.008 1.00 22.86 C ATOM 1666 CG PHE A 566 8.246 12.856 -30.072 1.00 23.93 C ATOM 1667 CD1 PHE A 566 8.599 12.034 -31.143 1.00 26.27 C ATOM 1668 CD2 PHE A 566 6.930 13.301 -29.983 1.00 24.78 C ATOM 1669 CE1 PHE A 566 7.658 11.680 -32.113 1.00 25.70 C ATOM 1670 CE2 PHE A 566 5.992 12.957 -30.958 1.00 27.37 C ATOM 1671 CZ PHE A 566 6.368 12.154 -32.024 1.00 25.06 C ATOM 0 H PHE A 566 7.897 12.660 -26.963 1.00 20.98 H new ATOM 0 HA PHE A 566 9.497 11.254 -28.543 1.00 21.57 H new ATOM 0 HB2 PHE A 566 8.958 14.003 -28.531 1.00 22.86 H new ATOM 0 HB3 PHE A 566 10.102 13.437 -29.427 1.00 22.86 H new ATOM 0 HD1 PHE A 566 9.471 11.718 -31.212 1.00 26.27 H new ATOM 0 HD2 PHE A 566 6.673 13.834 -29.265 1.00 24.78 H new ATOM 0 HE1 PHE A 566 7.902 11.125 -32.818 1.00 25.70 H new ATOM 0 HE2 PHE A 566 5.117 13.266 -30.893 1.00 27.37 H new ATOM 0 HZ PHE A 566 5.747 11.935 -32.681 1.00 25.06 H new ATOM 1672 N SER A 567 10.791 12.344 -25.950 1.00 22.59 N ATOM 1673 CA SER A 567 11.985 12.373 -25.081 1.00 22.22 C ATOM 1674 C SER A 567 12.130 11.034 -24.352 1.00 27.39 C ATOM 1675 O SER A 567 12.860 10.939 -23.363 1.00 25.81 O ATOM 1676 CB SER A 567 11.896 13.511 -24.066 1.00 21.76 C ATOM 1677 OG SER A 567 11.740 14.741 -24.748 1.00 23.66 O ATOM 0 H SER A 567 10.059 12.475 -25.519 1.00 22.59 H new ATOM 0 HA SER A 567 12.764 12.523 -25.638 1.00 22.22 H new ATOM 0 HB2 SER A 567 11.147 13.365 -23.467 1.00 21.76 H new ATOM 0 HB3 SER A 567 12.697 13.533 -23.519 1.00 21.76 H new ATOM 0 HG SER A 567 10.928 14.861 -24.927 1.00 23.66 H new ATOM 1678 N TYR A 568 11.395 10.009 -24.827 1.00 25.31 N ATOM 1679 CA TYR A 568 11.413 8.648 -24.284 1.00 25.97 C ATOM 1680 C TYR A 568 11.166 8.587 -22.764 1.00 29.26 C ATOM 1681 O TYR A 568 11.867 7.899 -22.024 1.00 27.79 O ATOM 1682 CB TYR A 568 12.683 7.895 -24.744 1.00 27.42 C ATOM 1683 CG TYR A 568 12.664 7.600 -26.231 1.00 28.82 C ATOM 1684 CD1 TYR A 568 12.269 6.354 -26.710 1.00 31.33 C ATOM 1685 CD2 TYR A 568 12.988 8.585 -27.163 1.00 29.35 C ATOM 1686 CE1 TYR A 568 12.203 6.094 -28.082 1.00 31.93 C ATOM 1687 CE2 TYR A 568 12.894 8.346 -28.533 1.00 30.23 C ATOM 1688 CZ TYR A 568 12.538 7.086 -28.987 1.00 36.32 C ATOM 1689 OH TYR A 568 12.464 6.846 -30.340 1.00 35.81 O ATOM 0 H TYR A 568 10.859 10.097 -25.494 1.00 25.31 H new ATOM 0 HA TYR A 568 10.652 8.176 -24.657 1.00 25.97 H new ATOM 0 HB2 TYR A 568 13.467 8.425 -24.531 1.00 27.42 H new ATOM 0 HB3 TYR A 568 12.760 7.063 -24.251 1.00 27.42 H new ATOM 0 HD1 TYR A 568 12.045 5.683 -26.107 1.00 31.33 H new ATOM 0 HD2 TYR A 568 13.273 9.419 -26.865 1.00 29.35 H new ATOM 0 HE1 TYR A 568 11.935 5.257 -28.386 1.00 31.93 H new ATOM 0 HE2 TYR A 568 13.069 9.029 -29.140 1.00 30.23 H new ATOM 0 HH TYR A 568 12.420 6.018 -30.476 1.00 35.81 H new ATOM 1690 N GLY A 569 10.148 9.315 -22.320 1.00 25.95 N ATOM 1691 CA GLY A 569 9.746 9.314 -20.918 1.00 25.87 C ATOM 1692 C GLY A 569 10.550 10.174 -19.970 1.00 30.59 C ATOM 1693 O GLY A 569 10.414 10.005 -18.756 1.00 31.56 O ATOM 0 H GLY A 569 9.670 9.824 -22.823 1.00 25.95 H new ATOM 0 HA2 GLY A 569 8.820 9.598 -20.870 1.00 25.87 H new ATOM 0 HA3 GLY A 569 9.779 8.400 -20.596 1.00 25.87 H new ATOM 1694 N GLN A 570 11.387 11.103 -20.484 1.00 27.62 N ATOM 1695 CA GLN A 570 12.138 12.012 -19.594 1.00 28.52 C ATOM 1696 C GLN A 570 11.147 12.986 -18.920 1.00 31.03 C ATOM 1697 O GLN A 570 10.123 13.324 -19.523 1.00 28.83 O ATOM 1698 CB GLN A 570 13.211 12.812 -20.359 1.00 30.69 C ATOM 1699 CG GLN A 570 14.461 11.991 -20.746 1.00 63.60 C ATOM 1700 CD GLN A 570 15.424 11.690 -19.614 1.00 89.47 C ATOM 1701 OE1 GLN A 570 15.818 10.536 -19.399 1.00 86.70 O ATOM 1702 NE2 GLN A 570 15.878 12.720 -18.903 1.00 82.40 N ATOM 0 H GLN A 570 11.529 11.219 -21.324 1.00 27.62 H new ATOM 0 HA GLN A 570 12.595 11.475 -18.928 1.00 28.52 H new ATOM 0 HB2 GLN A 570 12.814 13.176 -21.166 1.00 30.69 H new ATOM 0 HB3 GLN A 570 13.488 13.565 -19.814 1.00 30.69 H new ATOM 0 HG2 GLN A 570 14.169 11.151 -21.133 1.00 63.60 H new ATOM 0 HG3 GLN A 570 14.941 12.471 -21.439 1.00 63.60 H new ATOM 0 HE21 GLN A 570 15.593 13.515 -19.067 1.00 82.40 H new ATOM 0 HE22 GLN A 570 16.457 12.591 -18.280 1.00 82.40 H new ATOM 1703 N LYS A 571 11.441 13.414 -17.680 1.00 28.09 N ATOM 1704 CA LYS A 571 10.579 14.352 -16.935 1.00 28.23 C ATOM 1705 C LYS A 571 10.644 15.731 -17.615 1.00 29.55 C ATOM 1706 O LYS A 571 11.735 16.167 -17.978 1.00 29.45 O ATOM 1707 CB LYS A 571 11.057 14.527 -15.478 1.00 30.83 C ATOM 1708 CG LYS A 571 11.210 13.252 -14.656 1.00 49.33 C ATOM 1709 CD LYS A 571 12.174 13.494 -13.486 1.00 58.07 C ATOM 1710 CE LYS A 571 11.909 12.620 -12.279 1.00 74.11 C ATOM 1711 NZ LYS A 571 12.394 11.224 -12.462 1.00 83.78 N ATOM 0 H LYS A 571 12.144 13.169 -17.249 1.00 28.09 H new ATOM 0 HA LYS A 571 9.678 13.992 -16.932 1.00 28.23 H new ATOM 0 HB2 LYS A 571 11.912 14.984 -15.492 1.00 30.83 H new ATOM 0 HB3 LYS A 571 10.431 15.110 -15.021 1.00 30.83 H new ATOM 0 HG2 LYS A 571 10.345 12.970 -14.319 1.00 49.33 H new ATOM 0 HG3 LYS A 571 11.544 12.535 -15.217 1.00 49.33 H new ATOM 0 HD2 LYS A 571 13.082 13.342 -13.791 1.00 58.07 H new ATOM 0 HD3 LYS A 571 12.116 14.425 -13.219 1.00 58.07 H new ATOM 0 HE2 LYS A 571 12.340 13.009 -11.502 1.00 74.11 H new ATOM 0 HE3 LYS A 571 10.956 12.606 -12.097 1.00 74.11 H new ATOM 0 HZ1 LYS A 571 12.217 10.750 -11.730 1.00 83.78 H new ATOM 0 HZ2 LYS A 571 11.983 10.856 -13.160 1.00 83.78 H new ATOM 0 HZ3 LYS A 571 13.272 11.231 -12.605 1.00 83.78 H new ATOM 1712 N PRO A 572 9.521 16.457 -17.775 1.00 23.91 N ATOM 1713 CA PRO A 572 9.613 17.792 -18.389 1.00 22.93 C ATOM 1714 C PRO A 572 10.195 18.816 -17.412 1.00 24.21 C ATOM 1715 O PRO A 572 10.121 18.611 -16.184 1.00 22.70 O ATOM 1716 CB PRO A 572 8.150 18.114 -18.736 1.00 24.16 C ATOM 1717 CG PRO A 572 7.364 17.398 -17.711 1.00 27.80 C ATOM 1718 CD PRO A 572 8.125 16.117 -17.421 1.00 23.03 C ATOM 0 HA PRO A 572 10.201 17.818 -19.160 1.00 22.93 H new ATOM 0 HB2 PRO A 572 7.982 19.069 -18.708 1.00 24.16 H new ATOM 0 HB3 PRO A 572 7.924 17.812 -19.630 1.00 24.16 H new ATOM 0 HG2 PRO A 572 7.269 17.935 -16.909 1.00 27.80 H new ATOM 0 HG3 PRO A 572 6.469 17.205 -18.031 1.00 27.80 H new ATOM 0 HD2 PRO A 572 8.046 15.857 -16.490 1.00 23.03 H new ATOM 0 HD3 PRO A 572 7.792 15.376 -17.951 1.00 23.03 H new ATOM 1719 N TYR A 573 10.753 19.915 -17.954 1.00 20.91 N ATOM 1720 CA TYR A 573 11.334 21.046 -17.196 1.00 21.36 C ATOM 1721 C TYR A 573 12.300 20.536 -16.122 1.00 27.55 C ATOM 1722 O TYR A 573 12.180 20.905 -14.946 1.00 26.60 O ATOM 1723 CB TYR A 573 10.224 21.915 -16.550 1.00 21.59 C ATOM 1724 CG TYR A 573 9.181 22.426 -17.514 1.00 20.42 C ATOM 1725 CD1 TYR A 573 7.938 21.809 -17.619 1.00 22.08 C ATOM 1726 CD2 TYR A 573 9.425 23.543 -18.310 1.00 20.62 C ATOM 1727 CE1 TYR A 573 6.979 22.263 -18.524 1.00 22.93 C ATOM 1728 CE2 TYR A 573 8.489 23.990 -19.237 1.00 20.84 C ATOM 1729 CZ TYR A 573 7.251 23.366 -19.316 1.00 25.03 C ATOM 1730 OH TYR A 573 6.313 23.804 -20.208 1.00 22.78 O ATOM 0 H TYR A 573 10.805 20.026 -18.805 1.00 20.91 H new ATOM 0 HA TYR A 573 11.827 21.600 -17.821 1.00 21.36 H new ATOM 0 HB2 TYR A 573 9.782 21.394 -15.861 1.00 21.59 H new ATOM 0 HB3 TYR A 573 10.639 22.673 -16.110 1.00 21.59 H new ATOM 0 HD1 TYR A 573 7.743 21.080 -17.075 1.00 22.08 H new ATOM 0 HD2 TYR A 573 10.230 23.999 -18.220 1.00 20.62 H new ATOM 0 HE1 TYR A 573 6.161 21.827 -18.595 1.00 22.93 H new ATOM 0 HE2 TYR A 573 8.691 24.702 -19.800 1.00 20.84 H new ATOM 0 HH TYR A 573 5.916 23.144 -20.544 1.00 22.78 H new ATOM 1731 N ARG A 574 13.237 19.643 -16.537 1.00 25.18 N ATOM 1732 CA ARG A 574 14.243 18.987 -15.691 1.00 25.60 C ATOM 1733 C ARG A 574 14.935 20.001 -14.775 1.00 28.07 C ATOM 1734 O ARG A 574 15.308 21.074 -15.234 1.00 26.42 O ATOM 1735 CB ARG A 574 15.288 18.289 -16.600 1.00 28.13 C ATOM 1736 CG ARG A 574 16.374 17.518 -15.885 1.00 37.22 C ATOM 1737 CD ARG A 574 17.065 16.543 -16.814 1.00 32.76 C ATOM 1738 NE ARG A 574 17.996 17.177 -17.745 1.00 28.75 N ATOM 1739 CZ ARG A 574 18.539 16.549 -18.783 1.00 43.23 C ATOM 1740 NH1 ARG A 574 19.411 17.170 -19.558 1.00 33.04 N ATOM 1741 NH2 ARG A 574 18.202 15.294 -19.061 1.00 29.90 N ATOM 0 H ARG A 574 13.295 19.401 -17.360 1.00 25.18 H new ATOM 0 HA ARG A 574 13.803 18.330 -15.129 1.00 25.60 H new ATOM 0 HB2 ARG A 574 14.820 17.681 -17.193 1.00 28.13 H new ATOM 0 HB3 ARG A 574 15.707 18.963 -17.158 1.00 28.13 H new ATOM 0 HG2 ARG A 574 17.026 18.137 -15.521 1.00 37.22 H new ATOM 0 HG3 ARG A 574 15.991 17.036 -15.135 1.00 37.22 H new ATOM 0 HD2 ARG A 574 17.546 15.889 -16.283 1.00 32.76 H new ATOM 0 HD3 ARG A 574 16.393 16.059 -17.320 1.00 32.76 H new ATOM 0 HE ARG A 574 18.204 18.001 -17.614 1.00 28.75 H new ATOM 0 HH11 ARG A 574 19.630 17.985 -19.392 1.00 33.04 H new ATOM 0 HH12 ARG A 574 19.759 16.759 -20.228 1.00 33.04 H new ATOM 0 HH21 ARG A 574 17.629 14.883 -18.568 1.00 29.90 H new ATOM 0 HH22 ARG A 574 18.556 14.893 -19.734 1.00 29.90 H new ATOM 1742 N GLY A 575 15.011 19.675 -13.496 1.00 26.63 N ATOM 1743 CA GLY A 575 15.690 20.488 -12.492 1.00 28.12 C ATOM 1744 C GLY A 575 14.963 21.717 -11.992 1.00 33.60 C ATOM 1745 O GLY A 575 15.448 22.385 -11.071 1.00 34.68 O ATOM 0 H GLY A 575 14.662 18.957 -13.176 1.00 26.63 H new ATOM 0 HA2 GLY A 575 15.885 19.922 -11.728 1.00 28.12 H new ATOM 0 HA3 GLY A 575 16.542 20.771 -12.860 1.00 28.12 H new ATOM 1746 N MET A 576 13.787 22.008 -12.551 1.00 28.24 N ATOM 1747 CA MET A 576 13.049 23.217 -12.199 1.00 26.91 C ATOM 1748 C MET A 576 11.903 22.977 -11.248 1.00 32.43 C ATOM 1749 O MET A 576 11.331 21.889 -11.242 1.00 31.71 O ATOM 1750 CB MET A 576 12.540 23.912 -13.463 1.00 27.89 C ATOM 1751 CG MET A 576 13.633 24.256 -14.436 1.00 29.32 C ATOM 1752 SD MET A 576 12.997 24.824 -16.011 1.00 31.82 S ATOM 1753 CE MET A 576 12.316 26.478 -15.530 1.00 28.54 C ATOM 0 H MET A 576 13.400 21.514 -13.139 1.00 28.24 H new ATOM 0 HA MET A 576 13.678 23.788 -11.731 1.00 26.91 H new ATOM 0 HB2 MET A 576 11.894 23.337 -13.902 1.00 27.89 H new ATOM 0 HB3 MET A 576 12.072 24.724 -13.212 1.00 27.89 H new ATOM 0 HG2 MET A 576 14.199 24.944 -14.052 1.00 29.32 H new ATOM 0 HG3 MET A 576 14.192 23.476 -14.579 1.00 29.32 H new ATOM 0 HE1 MET A 576 12.222 27.032 -16.321 1.00 28.54 H new ATOM 0 HE2 MET A 576 11.448 26.362 -15.112 1.00 28.54 H new ATOM 0 HE3 MET A 576 12.920 26.908 -14.905 1.00 28.54 H new ATOM 1754 N LYS A 577 11.587 23.999 -10.425 1.00 31.73 N ATOM 1755 CA LYS A 577 10.450 24.028 -9.488 1.00 31.51 C ATOM 1756 C LYS A 577 9.246 24.581 -10.270 1.00 33.49 C ATOM 1757 O LYS A 577 9.444 25.289 -11.258 1.00 31.56 O ATOM 1758 CB LYS A 577 10.751 25.004 -8.326 1.00 34.74 C ATOM 1759 CG LYS A 577 11.882 24.558 -7.400 1.00 50.60 C ATOM 1760 CD LYS A 577 12.168 25.592 -6.318 1.00 57.09 C ATOM 1761 CE LYS A 577 13.226 25.101 -5.361 1.00 63.37 C ATOM 1762 NZ LYS A 577 13.650 26.162 -4.412 1.00 70.88 N ATOM 0 H LYS A 577 12.052 24.722 -10.400 1.00 31.73 H new ATOM 0 HA LYS A 577 10.283 23.142 -9.129 1.00 31.51 H new ATOM 0 HB2 LYS A 577 10.976 25.872 -8.697 1.00 34.74 H new ATOM 0 HB3 LYS A 577 9.945 25.121 -7.800 1.00 34.74 H new ATOM 0 HG2 LYS A 577 11.647 23.713 -6.986 1.00 50.60 H new ATOM 0 HG3 LYS A 577 12.685 24.405 -7.921 1.00 50.60 H new ATOM 0 HD2 LYS A 577 12.459 26.421 -6.728 1.00 57.09 H new ATOM 0 HD3 LYS A 577 11.353 25.788 -5.830 1.00 57.09 H new ATOM 0 HE2 LYS A 577 12.885 24.341 -4.864 1.00 63.37 H new ATOM 0 HE3 LYS A 577 13.996 24.790 -5.862 1.00 63.37 H new ATOM 0 HZ1 LYS A 577 14.273 25.839 -3.864 1.00 70.88 H new ATOM 0 HZ2 LYS A 577 13.983 26.851 -4.866 1.00 70.88 H new ATOM 0 HZ3 LYS A 577 12.948 26.433 -3.936 1.00 70.88 H new ATOM 1763 N GLY A 578 8.025 24.337 -9.777 1.00 32.59 N ATOM 1764 CA GLY A 578 6.795 24.853 -10.389 1.00 31.90 C ATOM 1765 C GLY A 578 6.818 26.347 -10.668 1.00 34.49 C ATOM 1766 O GLY A 578 6.480 26.768 -11.774 1.00 32.96 O ATOM 0 H GLY A 578 7.888 23.863 -9.072 1.00 32.59 H new ATOM 0 HA2 GLY A 578 6.637 24.381 -11.222 1.00 31.90 H new ATOM 0 HA3 GLY A 578 6.047 24.655 -9.804 1.00 31.90 H new ATOM 1767 N SER A 579 7.270 27.161 -9.682 1.00 31.70 N ATOM 1768 CA SER A 579 7.377 28.634 -9.789 1.00 30.85 C ATOM 1769 C SER A 579 8.347 29.098 -10.868 1.00 32.88 C ATOM 1770 O SER A 579 8.074 30.090 -11.559 1.00 31.79 O ATOM 1771 CB SER A 579 7.744 29.253 -8.440 1.00 36.41 C ATOM 1772 OG SER A 579 8.850 28.606 -7.828 1.00 46.14 O ATOM 0 H SER A 579 7.527 26.861 -8.918 1.00 31.70 H new ATOM 0 HA SER A 579 6.499 28.945 -10.058 1.00 30.85 H new ATOM 0 HB2 SER A 579 7.951 30.193 -8.564 1.00 36.41 H new ATOM 0 HB3 SER A 579 6.978 29.207 -7.847 1.00 36.41 H new ATOM 0 HG SER A 579 9.020 28.976 -7.093 1.00 46.14 H new ATOM 1773 N GLU A 580 9.466 28.358 -11.052 1.00 27.67 N ATOM 1774 CA GLU A 580 10.450 28.665 -12.104 1.00 27.04 C ATOM 1775 C GLU A 580 9.869 28.379 -13.489 1.00 28.07 C ATOM 1776 O GLU A 580 10.199 29.063 -14.449 1.00 27.58 O ATOM 1777 CB GLU A 580 11.750 27.867 -11.888 1.00 28.10 C ATOM 1778 CG GLU A 580 12.437 28.211 -10.573 1.00 36.70 C ATOM 1779 CD GLU A 580 13.661 27.381 -10.236 1.00 47.21 C ATOM 1780 OE1 GLU A 580 13.563 26.133 -10.212 1.00 44.25 O ATOM 1781 OE2 GLU A 580 14.709 27.988 -9.933 1.00 40.80 O1- ATOM 0 H GLU A 580 9.667 27.673 -10.572 1.00 27.67 H new ATOM 0 HA GLU A 580 10.661 29.610 -12.051 1.00 27.04 H new ATOM 0 HB2 GLU A 580 11.550 26.918 -11.906 1.00 28.10 H new ATOM 0 HB3 GLU A 580 12.359 28.042 -12.623 1.00 28.10 H new ATOM 0 HG2 GLU A 580 12.696 29.145 -10.597 1.00 36.70 H new ATOM 0 HG3 GLU A 580 11.792 28.114 -9.855 1.00 36.70 H new ATOM 1782 N VAL A 581 9.013 27.364 -13.596 1.00 25.03 N ATOM 1783 CA VAL A 581 8.363 27.044 -14.878 1.00 24.76 C ATOM 1784 C VAL A 581 7.399 28.179 -15.257 1.00 27.28 C ATOM 1785 O VAL A 581 7.423 28.666 -16.387 1.00 25.49 O ATOM 1786 CB VAL A 581 7.683 25.646 -14.852 1.00 28.01 C ATOM 1787 CG1 VAL A 581 6.949 25.364 -16.169 1.00 27.59 C ATOM 1788 CG2 VAL A 581 8.714 24.556 -14.564 1.00 28.00 C ATOM 0 H VAL A 581 8.793 26.848 -12.944 1.00 25.03 H new ATOM 0 HA VAL A 581 9.038 26.982 -15.572 1.00 24.76 H new ATOM 0 HB VAL A 581 7.025 25.644 -14.139 1.00 28.01 H new ATOM 0 HG11 VAL A 581 6.534 24.488 -16.127 1.00 27.59 H new ATOM 0 HG12 VAL A 581 6.266 26.038 -16.310 1.00 27.59 H new ATOM 0 HG13 VAL A 581 7.582 25.387 -16.904 1.00 27.59 H new ATOM 0 HG21 VAL A 581 8.276 23.691 -14.551 1.00 28.00 H new ATOM 0 HG22 VAL A 581 9.394 24.563 -15.256 1.00 28.00 H new ATOM 0 HG23 VAL A 581 9.128 24.721 -13.702 1.00 28.00 H new ATOM 1789 N THR A 582 6.565 28.620 -14.301 1.00 26.91 N ATOM 1790 CA THR A 582 5.622 29.724 -14.533 1.00 26.66 C ATOM 1791 C THR A 582 6.382 30.965 -15.017 1.00 30.08 C ATOM 1792 O THR A 582 5.996 31.576 -16.019 1.00 28.52 O ATOM 1793 CB THR A 582 4.764 29.966 -13.263 1.00 38.32 C ATOM 1794 OG1 THR A 582 4.107 28.747 -12.905 1.00 39.28 O ATOM 1795 CG2 THR A 582 3.724 31.064 -13.454 1.00 36.66 C ATOM 0 H THR A 582 6.532 28.290 -13.508 1.00 26.91 H new ATOM 0 HA THR A 582 4.998 29.495 -15.239 1.00 26.66 H new ATOM 0 HB THR A 582 5.362 30.259 -12.558 1.00 38.32 H new ATOM 0 HG1 THR A 582 3.642 28.871 -12.217 1.00 39.28 H new ATOM 0 HG21 THR A 582 3.217 31.175 -12.635 1.00 36.66 H new ATOM 0 HG22 THR A 582 4.169 31.897 -13.674 1.00 36.66 H new ATOM 0 HG23 THR A 582 3.123 30.819 -14.175 1.00 36.66 H new ATOM 1796 N ALA A 583 7.507 31.290 -14.347 1.00 29.32 N ATOM 1797 CA ALA A 583 8.372 32.413 -14.700 1.00 29.90 C ATOM 1798 C ALA A 583 8.932 32.255 -16.132 1.00 32.13 C ATOM 1799 O ALA A 583 8.917 33.219 -16.902 1.00 32.16 O ATOM 1800 CB ALA A 583 9.514 32.525 -13.686 1.00 31.44 C ATOM 0 H ALA A 583 7.785 30.849 -13.663 1.00 29.32 H new ATOM 0 HA ALA A 583 7.845 33.227 -14.677 1.00 29.90 H new ATOM 0 HB1 ALA A 583 10.086 33.271 -13.924 1.00 31.44 H new ATOM 0 HB2 ALA A 583 9.147 32.669 -12.800 1.00 31.44 H new ATOM 0 HB3 ALA A 583 10.033 31.706 -13.691 1.00 31.44 H new ATOM 1801 N MET A 584 9.388 31.030 -16.490 1.00 27.47 N ATOM 1802 CA MET A 584 9.927 30.692 -17.821 1.00 25.80 C ATOM 1803 C MET A 584 8.853 30.903 -18.895 1.00 29.00 C ATOM 1804 O MET A 584 9.117 31.542 -19.911 1.00 27.64 O ATOM 1805 CB MET A 584 10.419 29.219 -17.831 1.00 27.07 C ATOM 1806 CG MET A 584 10.986 28.766 -19.172 1.00 29.90 C ATOM 1807 SD MET A 584 11.358 26.984 -19.205 1.00 32.55 S ATOM 1808 CE MET A 584 11.495 26.748 -20.893 1.00 29.93 C ATOM 0 H MET A 584 9.389 30.362 -15.948 1.00 27.47 H new ATOM 0 HA MET A 584 10.677 31.275 -18.017 1.00 25.80 H new ATOM 0 HB2 MET A 584 11.100 29.110 -17.149 1.00 27.07 H new ATOM 0 HB3 MET A 584 9.680 28.639 -17.590 1.00 27.07 H new ATOM 0 HG2 MET A 584 10.351 28.974 -19.875 1.00 29.90 H new ATOM 0 HG3 MET A 584 11.795 29.266 -19.363 1.00 29.90 H new ATOM 0 HE1 MET A 584 11.698 25.817 -21.074 1.00 29.93 H new ATOM 0 HE2 MET A 584 10.658 26.986 -21.322 1.00 29.93 H new ATOM 0 HE3 MET A 584 12.207 27.307 -21.241 1.00 29.93 H new ATOM 1809 N LEU A 585 7.639 30.351 -18.671 1.00 26.21 N ATOM 1810 CA LEU A 585 6.531 30.466 -19.636 1.00 25.88 C ATOM 1811 C LEU A 585 6.092 31.907 -19.825 1.00 31.16 C ATOM 1812 O LEU A 585 5.826 32.326 -20.952 1.00 30.28 O ATOM 1813 CB LEU A 585 5.336 29.567 -19.218 1.00 25.46 C ATOM 1814 CG LEU A 585 5.639 28.053 -19.126 1.00 28.55 C ATOM 1815 CD1 LEU A 585 4.495 27.307 -18.475 1.00 28.91 C ATOM 1816 CD2 LEU A 585 6.019 27.466 -20.485 1.00 27.73 C ATOM 0 H LEU A 585 7.442 29.906 -17.962 1.00 26.21 H new ATOM 0 HA LEU A 585 6.860 30.153 -20.493 1.00 25.88 H new ATOM 0 HB2 LEU A 585 5.011 29.869 -18.355 1.00 25.46 H new ATOM 0 HB3 LEU A 585 4.615 29.698 -19.854 1.00 25.46 H new ATOM 0 HG LEU A 585 6.415 27.941 -18.554 1.00 28.55 H new ATOM 0 HD11 LEU A 585 4.709 26.362 -18.429 1.00 28.91 H new ATOM 0 HD12 LEU A 585 4.353 27.650 -17.579 1.00 28.91 H new ATOM 0 HD13 LEU A 585 3.688 27.430 -18.999 1.00 28.91 H new ATOM 0 HD21 LEU A 585 6.201 26.518 -20.389 1.00 27.73 H new ATOM 0 HD22 LEU A 585 5.287 27.592 -21.108 1.00 27.73 H new ATOM 0 HD23 LEU A 585 6.810 27.915 -20.822 1.00 27.73 H new ATOM 1817 N GLU A 586 6.083 32.682 -18.728 1.00 29.62 N ATOM 1818 CA GLU A 586 5.711 34.098 -18.756 1.00 30.96 C ATOM 1819 C GLU A 586 6.689 34.961 -19.582 1.00 36.81 C ATOM 1820 O GLU A 586 6.276 35.997 -20.104 1.00 38.46 O ATOM 1821 CB GLU A 586 5.558 34.622 -17.331 1.00 32.37 C ATOM 1822 CG GLU A 586 4.659 35.836 -17.232 1.00 40.42 C ATOM 1823 CD GLU A 586 4.263 36.151 -15.809 1.00 51.36 C ATOM 1824 OE1 GLU A 586 3.454 35.386 -15.240 1.00 42.30 O ATOM 1825 OE2 GLU A 586 4.721 37.188 -15.280 1.00 51.06 O1- ATOM 0 H GLU A 586 6.294 32.394 -17.946 1.00 29.62 H new ATOM 0 HA GLU A 586 4.856 34.168 -19.210 1.00 30.96 H new ATOM 0 HB2 GLU A 586 5.200 33.916 -16.770 1.00 32.37 H new ATOM 0 HB3 GLU A 586 6.434 34.847 -16.980 1.00 32.37 H new ATOM 0 HG2 GLU A 586 5.113 36.603 -17.615 1.00 40.42 H new ATOM 0 HG3 GLU A 586 3.860 35.686 -17.761 1.00 40.42 H new ATOM 1826 N LYS A 587 7.962 34.507 -19.731 1.00 32.89 N ATOM 1827 CA LYS A 587 9.033 35.141 -20.520 1.00 32.46 C ATOM 1828 C LYS A 587 8.959 34.757 -22.010 1.00 35.22 C ATOM 1829 O LYS A 587 9.830 35.170 -22.790 1.00 34.42 O ATOM 1830 CB LYS A 587 10.420 34.719 -19.992 1.00 34.24 C ATOM 1831 CG LYS A 587 10.858 35.397 -18.709 1.00 40.21 C ATOM 1832 CD LYS A 587 12.256 34.949 -18.353 1.00 48.97 C ATOM 1833 CE LYS A 587 12.484 34.874 -16.870 1.00 59.25 C ATOM 1834 NZ LYS A 587 13.729 34.123 -16.553 1.00 72.65 N ATOM 0 H LYS A 587 8.227 33.783 -19.350 1.00 32.89 H new ATOM 0 HA LYS A 587 8.908 36.099 -20.430 1.00 32.46 H new ATOM 0 HB2 LYS A 587 10.417 33.760 -19.849 1.00 34.24 H new ATOM 0 HB3 LYS A 587 11.080 34.901 -20.679 1.00 34.24 H new ATOM 0 HG2 LYS A 587 10.835 36.361 -18.817 1.00 40.21 H new ATOM 0 HG3 LYS A 587 10.245 35.177 -17.990 1.00 40.21 H new ATOM 0 HD2 LYS A 587 12.422 34.078 -18.746 1.00 48.97 H new ATOM 0 HD3 LYS A 587 12.897 35.563 -18.744 1.00 48.97 H new ATOM 0 HE2 LYS A 587 12.542 35.770 -16.504 1.00 59.25 H new ATOM 0 HE3 LYS A 587 11.726 34.442 -16.445 1.00 59.25 H new ATOM 0 HZ1 LYS A 587 13.841 34.093 -15.671 1.00 72.65 H new ATOM 0 HZ2 LYS A 587 13.666 33.295 -16.872 1.00 72.65 H new ATOM 0 HZ3 LYS A 587 14.426 34.532 -16.926 1.00 72.65 H new ATOM 1835 N GLY A 588 7.965 33.939 -22.375 1.00 29.16 N ATOM 1836 CA GLY A 588 7.772 33.463 -23.745 1.00 26.94 C ATOM 1837 C GLY A 588 8.677 32.288 -24.093 1.00 28.07 C ATOM 1838 O GLY A 588 8.770 31.900 -25.258 1.00 28.22 O ATOM 0 H GLY A 588 7.376 33.642 -21.823 1.00 29.16 H new ATOM 0 HA2 GLY A 588 6.846 33.199 -23.864 1.00 26.94 H new ATOM 0 HA3 GLY A 588 7.942 34.191 -24.363 1.00 26.94 H new ATOM 1839 N GLU A 589 9.330 31.691 -23.090 1.00 23.94 N ATOM 1840 CA GLU A 589 10.232 30.562 -23.350 1.00 24.00 C ATOM 1841 C GLU A 589 9.520 29.222 -23.251 1.00 26.95 C ATOM 1842 O GLU A 589 8.647 29.040 -22.389 1.00 24.36 O ATOM 1843 CB GLU A 589 11.444 30.580 -22.410 1.00 25.90 C ATOM 1844 CG GLU A 589 12.360 31.785 -22.565 1.00 38.84 C ATOM 1845 CD GLU A 589 13.382 31.943 -21.451 1.00 60.62 C ATOM 1846 OE1 GLU A 589 13.565 30.994 -20.653 1.00 53.17 O ATOM 1847 OE2 GLU A 589 13.995 33.030 -21.369 1.00 60.46 O1- ATOM 0 H GLU A 589 9.266 31.920 -22.264 1.00 23.94 H new ATOM 0 HA GLU A 589 10.544 30.669 -24.262 1.00 24.00 H new ATOM 0 HB2 GLU A 589 11.126 30.548 -21.494 1.00 25.90 H new ATOM 0 HB3 GLU A 589 11.964 29.774 -22.559 1.00 25.90 H new ATOM 0 HG2 GLU A 589 12.828 31.715 -23.411 1.00 38.84 H new ATOM 0 HG3 GLU A 589 11.817 32.587 -22.607 1.00 38.84 H new ATOM 1848 N ARG A 590 9.930 28.278 -24.118 1.00 23.91 N ATOM 1849 CA ARG A 590 9.399 26.909 -24.174 1.00 23.90 C ATOM 1850 C ARG A 590 10.551 25.893 -24.239 1.00 27.53 C ATOM 1851 O ARG A 590 11.665 26.232 -24.685 1.00 26.40 O ATOM 1852 CB ARG A 590 8.477 26.724 -25.400 1.00 22.72 C ATOM 1853 CG ARG A 590 7.287 27.711 -25.500 1.00 28.39 C ATOM 1854 CD ARG A 590 6.230 27.497 -24.432 1.00 20.87 C ATOM 1855 NE ARG A 590 5.055 28.371 -24.608 1.00 30.01 N ATOM 1856 CZ ARG A 590 4.901 29.569 -24.039 1.00 36.16 C ATOM 1857 NH1 ARG A 590 5.852 30.073 -23.264 1.00 21.40 N ATOM 1858 NH2 ARG A 590 3.792 30.267 -24.239 1.00 25.36 N ATOM 0 H ARG A 590 10.542 28.425 -24.704 1.00 23.91 H new ATOM 0 HA ARG A 590 8.880 26.757 -23.369 1.00 23.90 H new ATOM 0 HB2 ARG A 590 9.014 26.808 -26.203 1.00 22.72 H new ATOM 0 HB3 ARG A 590 8.126 25.820 -25.387 1.00 22.72 H new ATOM 0 HG2 ARG A 590 7.623 28.619 -25.435 1.00 28.39 H new ATOM 0 HG3 ARG A 590 6.876 27.623 -26.374 1.00 28.39 H new ATOM 0 HD2 ARG A 590 5.944 26.570 -24.447 1.00 20.87 H new ATOM 0 HD3 ARG A 590 6.621 27.659 -23.559 1.00 20.87 H new ATOM 0 HE ARG A 590 4.421 28.088 -25.115 1.00 30.01 H new ATOM 0 HH11 ARG A 590 6.574 29.628 -23.125 1.00 21.40 H new ATOM 0 HH12 ARG A 590 5.746 30.845 -22.901 1.00 21.40 H new ATOM 0 HH21 ARG A 590 3.167 29.949 -24.737 1.00 25.36 H new ATOM 0 HH22 ARG A 590 3.697 31.038 -23.871 1.00 25.36 H new ATOM 1859 N MET A 591 10.267 24.636 -23.823 1.00 22.04 N ATOM 1860 CA MET A 591 11.226 23.536 -23.896 1.00 21.50 C ATOM 1861 C MET A 591 11.636 23.358 -25.352 1.00 26.06 C ATOM 1862 O MET A 591 10.816 23.564 -26.258 1.00 24.16 O ATOM 1863 CB MET A 591 10.583 22.217 -23.393 1.00 23.50 C ATOM 1864 CG MET A 591 10.366 22.167 -21.902 1.00 26.20 C ATOM 1865 SD MET A 591 9.831 20.531 -21.308 1.00 29.10 S ATOM 1866 CE MET A 591 8.127 20.517 -21.833 1.00 24.42 C ATOM 0 H MET A 591 9.506 24.410 -23.491 1.00 22.04 H new ATOM 0 HA MET A 591 11.993 23.741 -23.339 1.00 21.50 H new ATOM 0 HB2 MET A 591 9.730 22.094 -23.838 1.00 23.50 H new ATOM 0 HB3 MET A 591 11.149 21.473 -23.653 1.00 23.50 H new ATOM 0 HG2 MET A 591 11.190 22.414 -21.453 1.00 26.20 H new ATOM 0 HG3 MET A 591 9.700 22.828 -21.656 1.00 26.20 H new ATOM 0 HE1 MET A 591 7.715 19.679 -21.572 1.00 24.42 H new ATOM 0 HE2 MET A 591 7.654 21.254 -21.416 1.00 24.42 H new ATOM 0 HE3 MET A 591 8.085 20.611 -22.798 1.00 24.42 H new ATOM 1867 N GLY A 592 12.896 22.987 -25.553 1.00 26.71 N ATOM 1868 CA GLY A 592 13.462 22.715 -26.874 1.00 27.46 C ATOM 1869 C GLY A 592 12.957 21.434 -27.510 1.00 31.23 C ATOM 1870 O GLY A 592 12.230 20.649 -26.894 1.00 30.86 O ATOM 0 H GLY A 592 13.460 22.884 -24.912 1.00 26.71 H new ATOM 0 HA2 GLY A 592 13.259 23.459 -27.462 1.00 27.46 H new ATOM 0 HA3 GLY A 592 14.428 22.669 -26.798 1.00 27.46 H new ATOM 1871 N CYS A 593 13.354 21.209 -28.754 1.00 28.09 N ATOM 1872 CA CYS A 593 12.963 20.043 -29.532 1.00 28.10 C ATOM 1873 C CYS A 593 13.743 18.808 -29.059 1.00 31.14 C ATOM 1874 O CYS A 593 14.970 18.872 -29.007 1.00 31.81 O ATOM 1875 CB CYS A 593 13.190 20.325 -31.017 1.00 28.72 C ATOM 1876 SG CYS A 593 12.688 18.988 -32.119 1.00 33.06 S ATOM 0 H CYS A 593 13.873 21.745 -29.181 1.00 28.09 H new ATOM 0 HA CYS A 593 12.020 19.858 -29.401 1.00 28.10 H new ATOM 0 HB2 CYS A 593 12.704 21.128 -31.260 1.00 28.72 H new ATOM 0 HB3 CYS A 593 14.132 20.509 -31.159 1.00 28.72 H new ATOM 0 HG CYS A 593 12.903 19.304 -33.256 1.00 33.06 H new ATOM 1877 N PRO A 594 13.077 17.696 -28.644 1.00 27.44 N ATOM 1878 CA PRO A 594 13.844 16.492 -28.219 1.00 26.39 C ATOM 1879 C PRO A 594 14.691 15.914 -29.369 1.00 28.81 C ATOM 1880 O PRO A 594 14.299 16.047 -30.527 1.00 26.06 O ATOM 1881 CB PRO A 594 12.745 15.488 -27.844 1.00 27.88 C ATOM 1882 CG PRO A 594 11.491 16.331 -27.622 1.00 32.04 C ATOM 1883 CD PRO A 594 11.617 17.459 -28.587 1.00 28.11 C ATOM 0 HA PRO A 594 14.465 16.693 -27.501 1.00 26.39 H new ATOM 0 HB2 PRO A 594 12.609 14.837 -28.550 1.00 27.88 H new ATOM 0 HB3 PRO A 594 12.981 14.993 -27.044 1.00 27.88 H new ATOM 0 HG2 PRO A 594 10.686 15.815 -27.786 1.00 32.04 H new ATOM 0 HG3 PRO A 594 11.440 16.653 -26.708 1.00 32.04 H new ATOM 0 HD2 PRO A 594 11.258 17.227 -29.458 1.00 28.11 H new ATOM 0 HD3 PRO A 594 11.138 18.246 -28.283 1.00 28.11 H new ATOM 1884 N ALA A 595 15.826 15.253 -29.059 1.00 29.04 N ATOM 1885 CA ALA A 595 16.702 14.630 -30.070 1.00 29.57 C ATOM 1886 C ALA A 595 15.926 13.653 -30.953 1.00 34.52 C ATOM 1887 O ALA A 595 15.213 12.800 -30.434 1.00 35.39 O ATOM 1888 CB ALA A 595 17.857 13.915 -29.392 1.00 30.80 C ATOM 0 H ALA A 595 16.107 15.155 -28.252 1.00 29.04 H new ATOM 0 HA ALA A 595 17.051 15.335 -30.638 1.00 29.57 H new ATOM 0 HB1 ALA A 595 18.426 13.509 -30.065 1.00 30.80 H new ATOM 0 HB2 ALA A 595 18.373 14.552 -28.874 1.00 30.80 H new ATOM 0 HB3 ALA A 595 17.511 13.226 -28.804 1.00 30.80 H new ATOM 1889 N GLY A 596 16.010 13.847 -32.267 1.00 30.89 N ATOM 1890 CA GLY A 596 15.335 13.022 -33.268 1.00 30.53 C ATOM 1891 C GLY A 596 13.847 13.269 -33.451 1.00 34.63 C ATOM 1892 O GLY A 596 13.195 12.558 -34.231 1.00 34.52 O ATOM 0 H GLY A 596 16.476 14.482 -32.612 1.00 30.89 H new ATOM 0 HA2 GLY A 596 15.774 13.159 -34.122 1.00 30.53 H new ATOM 0 HA3 GLY A 596 15.462 12.090 -33.031 1.00 30.53 H new ATOM 1893 N CYS A 597 13.283 14.283 -32.754 1.00 29.89 N ATOM 1894 CA CYS A 597 11.849 14.557 -32.883 1.00 29.26 C ATOM 1895 C CYS A 597 11.580 15.270 -34.204 1.00 32.07 C ATOM 1896 O CYS A 597 12.219 16.290 -34.452 1.00 32.39 O ATOM 1897 CB CYS A 597 11.314 15.362 -31.696 1.00 29.06 C ATOM 1898 SG CYS A 597 9.588 15.874 -31.874 1.00 32.71 S ATOM 0 H CYS A 597 13.708 14.805 -32.218 1.00 29.89 H new ATOM 0 HA CYS A 597 11.374 13.711 -32.880 1.00 29.26 H new ATOM 0 HB2 CYS A 597 11.403 14.830 -30.890 1.00 29.06 H new ATOM 0 HB3 CYS A 597 11.865 16.151 -31.577 1.00 29.06 H new ATOM 0 HG CYS A 597 8.873 15.056 -31.365 1.00 32.71 H new ATOM 1899 N PRO A 598 10.628 14.791 -35.039 1.00 28.91 N ATOM 1900 CA PRO A 598 10.346 15.493 -36.308 1.00 29.39 C ATOM 1901 C PRO A 598 9.907 16.931 -36.068 1.00 35.27 C ATOM 1902 O PRO A 598 9.205 17.195 -35.082 1.00 33.24 O ATOM 1903 CB PRO A 598 9.214 14.666 -36.924 1.00 31.12 C ATOM 1904 CG PRO A 598 9.356 13.289 -36.296 1.00 34.35 C ATOM 1905 CD PRO A 598 9.785 13.582 -34.893 1.00 29.72 C ATOM 0 HA PRO A 598 11.126 15.559 -36.881 1.00 29.39 H new ATOM 0 HB2 PRO A 598 8.347 15.055 -36.729 1.00 31.12 H new ATOM 0 HB3 PRO A 598 9.294 14.623 -37.890 1.00 31.12 H new ATOM 0 HG2 PRO A 598 8.519 12.799 -36.318 1.00 34.35 H new ATOM 0 HG3 PRO A 598 10.012 12.750 -36.764 1.00 34.35 H new ATOM 0 HD2 PRO A 598 9.025 13.744 -34.313 1.00 29.72 H new ATOM 0 HD3 PRO A 598 10.283 12.843 -34.509 1.00 29.72 H new ATOM 1906 N ARG A 599 10.343 17.865 -36.949 1.00 34.02 N ATOM 1907 CA ARG A 599 10.002 19.288 -36.837 1.00 34.48 C ATOM 1908 C ARG A 599 8.491 19.547 -36.790 1.00 35.44 C ATOM 1909 O ARG A 599 8.055 20.398 -36.023 1.00 34.60 O ATOM 1910 CB ARG A 599 10.691 20.146 -37.924 1.00 36.88 C ATOM 1911 CG ARG A 599 12.227 20.246 -37.798 1.00 51.86 C ATOM 1912 CD ARG A 599 12.765 20.681 -36.426 1.00 63.82 C ATOM 1913 NE ARG A 599 12.337 22.030 -36.040 1.00 70.47 N ATOM 1914 CZ ARG A 599 12.744 22.663 -34.943 1.00 81.42 C ATOM 1915 NH1 ARG A 599 12.307 23.886 -34.677 1.00 66.34 N ATOM 1916 NH2 ARG A 599 13.601 22.084 -34.110 1.00 68.32 N ATOM 0 H ARG A 599 10.843 17.680 -37.624 1.00 34.02 H new ATOM 0 HA ARG A 599 10.355 19.570 -35.979 1.00 34.48 H new ATOM 0 HB2 ARG A 599 10.474 19.777 -38.794 1.00 36.88 H new ATOM 0 HB3 ARG A 599 10.318 21.041 -37.895 1.00 36.88 H new ATOM 0 HG2 ARG A 599 12.608 19.381 -38.015 1.00 51.86 H new ATOM 0 HG3 ARG A 599 12.548 20.873 -38.465 1.00 51.86 H new ATOM 0 HD2 ARG A 599 12.468 20.049 -35.753 1.00 63.82 H new ATOM 0 HD3 ARG A 599 13.734 20.647 -36.439 1.00 63.82 H new ATOM 0 HE ARG A 599 11.786 22.439 -36.558 1.00 70.47 H new ATOM 0 HH11 ARG A 599 11.758 24.273 -35.214 1.00 66.34 H new ATOM 0 HH12 ARG A 599 12.572 24.292 -33.967 1.00 66.34 H new ATOM 0 HH21 ARG A 599 13.897 21.294 -34.278 1.00 68.32 H new ATOM 0 HH22 ARG A 599 13.860 22.499 -33.403 1.00 68.32 H new ATOM 1917 N GLU A 600 7.704 18.797 -37.583 1.00 30.55 N ATOM 1918 CA GLU A 600 6.245 18.905 -37.615 1.00 30.56 C ATOM 1919 C GLU A 600 5.633 18.575 -36.237 1.00 30.79 C ATOM 1920 O GLU A 600 4.658 19.206 -35.839 1.00 29.30 O ATOM 1921 CB GLU A 600 5.647 18.002 -38.706 1.00 32.53 C ATOM 1922 CG GLU A 600 6.140 18.335 -40.114 1.00 45.82 C ATOM 1923 CD GLU A 600 7.363 17.592 -40.636 1.00 62.36 C ATOM 1924 OE1 GLU A 600 8.245 17.213 -39.829 1.00 42.09 O ATOM 1925 OE2 GLU A 600 7.452 17.418 -41.873 1.00 60.38 O1- ATOM 0 H GLU A 600 8.015 18.204 -38.123 1.00 30.55 H new ATOM 0 HA GLU A 600 6.023 19.824 -37.830 1.00 30.56 H new ATOM 0 HB2 GLU A 600 5.864 17.078 -38.506 1.00 32.53 H new ATOM 0 HB3 GLU A 600 4.680 18.077 -38.684 1.00 32.53 H new ATOM 0 HG2 GLU A 600 5.409 18.175 -40.731 1.00 45.82 H new ATOM 0 HG3 GLU A 600 6.334 19.285 -40.144 1.00 45.82 H new ATOM 1926 N MET A 601 6.237 17.623 -35.505 1.00 25.59 N ATOM 1927 CA MET A 601 5.765 17.248 -34.161 1.00 24.55 C ATOM 1928 C MET A 601 6.149 18.295 -33.116 1.00 27.06 C ATOM 1929 O MET A 601 5.346 18.597 -32.228 1.00 25.67 O ATOM 1930 CB MET A 601 6.179 15.812 -33.787 1.00 25.98 C ATOM 1931 CG MET A 601 5.541 14.758 -34.709 1.00 28.64 C ATOM 1932 SD MET A 601 3.736 14.571 -34.525 1.00 31.39 S ATOM 1933 CE MET A 601 3.100 15.637 -35.805 1.00 29.69 C ATOM 0 H MET A 601 6.925 17.181 -35.772 1.00 25.59 H new ATOM 0 HA MET A 601 4.795 17.239 -34.177 1.00 24.55 H new ATOM 0 HB2 MET A 601 7.145 15.735 -33.832 1.00 25.98 H new ATOM 0 HB3 MET A 601 5.922 15.633 -32.869 1.00 25.98 H new ATOM 0 HG2 MET A 601 5.737 14.991 -35.630 1.00 28.64 H new ATOM 0 HG3 MET A 601 5.961 13.901 -34.538 1.00 28.64 H new ATOM 0 HE1 MET A 601 2.780 16.463 -35.409 1.00 29.69 H new ATOM 0 HE2 MET A 601 3.805 15.835 -36.441 1.00 29.69 H new ATOM 0 HE3 MET A 601 2.368 15.193 -36.262 1.00 29.69 H new ATOM 1934 N TYR A 602 7.331 18.918 -33.271 1.00 23.46 N ATOM 1935 CA TYR A 602 7.742 19.990 -32.374 1.00 23.98 C ATOM 1936 C TYR A 602 6.887 21.245 -32.612 1.00 28.24 C ATOM 1937 O TYR A 602 6.511 21.910 -31.648 1.00 25.24 O ATOM 1938 CB TYR A 602 9.237 20.302 -32.489 1.00 25.49 C ATOM 1939 CG TYR A 602 9.697 21.338 -31.490 1.00 27.74 C ATOM 1940 CD1 TYR A 602 9.550 21.130 -30.120 1.00 29.03 C ATOM 1941 CD2 TYR A 602 10.252 22.544 -31.912 1.00 29.63 C ATOM 1942 CE1 TYR A 602 9.953 22.091 -29.196 1.00 28.82 C ATOM 1943 CE2 TYR A 602 10.692 23.497 -30.996 1.00 30.93 C ATOM 1944 CZ TYR A 602 10.537 23.270 -29.639 1.00 36.82 C ATOM 1945 OH TYR A 602 10.966 24.222 -28.740 1.00 33.46 O ATOM 0 H TYR A 602 7.899 18.729 -33.888 1.00 23.46 H new ATOM 0 HA TYR A 602 7.594 19.684 -31.465 1.00 23.98 H new ATOM 0 HB2 TYR A 602 9.745 19.486 -32.359 1.00 25.49 H new ATOM 0 HB3 TYR A 602 9.430 20.616 -33.386 1.00 25.49 H new ATOM 0 HD1 TYR A 602 9.176 20.334 -29.817 1.00 29.03 H new ATOM 0 HD2 TYR A 602 10.330 22.716 -32.823 1.00 29.63 H new ATOM 0 HE1 TYR A 602 9.831 21.943 -28.286 1.00 28.82 H new ATOM 0 HE2 TYR A 602 11.089 24.283 -31.295 1.00 30.93 H new ATOM 0 HH TYR A 602 10.824 23.953 -27.957 1.00 33.46 H new ATOM 1946 N ASP A 603 6.550 21.533 -33.890 1.00 26.45 N ATOM 1947 CA ASP A 603 5.676 22.639 -34.282 1.00 27.10 C ATOM 1948 C ASP A 603 4.300 22.474 -33.615 1.00 29.22 C ATOM 1949 O ASP A 603 3.758 23.452 -33.090 1.00 28.40 O ATOM 1950 CB ASP A 603 5.510 22.683 -35.817 1.00 29.46 C ATOM 1951 CG ASP A 603 6.741 23.192 -36.557 1.00 42.99 C ATOM 1952 OD1 ASP A 603 7.732 23.576 -35.880 1.00 43.44 O ATOM 1953 OD2 ASP A 603 6.724 23.187 -37.808 1.00 49.07 O1- ATOM 0 H ASP A 603 6.835 21.074 -34.559 1.00 26.45 H new ATOM 0 HA ASP A 603 6.080 23.471 -33.991 1.00 27.10 H new ATOM 0 HB2 ASP A 603 5.297 21.792 -36.136 1.00 29.46 H new ATOM 0 HB3 ASP A 603 4.754 23.251 -36.036 1.00 29.46 H new ATOM 1954 N LEU A 604 3.767 21.227 -33.605 1.00 24.96 N ATOM 1955 CA LEU A 604 2.482 20.895 -32.984 1.00 24.57 C ATOM 1956 C LEU A 604 2.520 21.133 -31.482 1.00 27.81 C ATOM 1957 O LEU A 604 1.559 21.697 -30.956 1.00 27.55 O ATOM 1958 CB LEU A 604 2.033 19.463 -33.311 1.00 24.69 C ATOM 1959 CG LEU A 604 0.575 19.087 -32.947 1.00 28.84 C ATOM 1960 CD1 LEU A 604 -0.452 20.069 -33.549 1.00 28.63 C ATOM 1961 CD2 LEU A 604 0.264 17.694 -33.402 1.00 30.31 C ATOM 0 H LEU A 604 4.156 20.551 -33.966 1.00 24.96 H new ATOM 0 HA LEU A 604 1.819 21.492 -33.365 1.00 24.57 H new ATOM 0 HB2 LEU A 604 2.154 19.318 -34.263 1.00 24.69 H new ATOM 0 HB3 LEU A 604 2.627 18.848 -32.853 1.00 24.69 H new ATOM 0 HG LEU A 604 0.504 19.140 -31.981 1.00 28.84 H new ATOM 0 HD11 LEU A 604 -1.348 19.796 -33.296 1.00 28.63 H new ATOM 0 HD12 LEU A 604 -0.280 20.963 -33.214 1.00 28.63 H new ATOM 0 HD13 LEU A 604 -0.374 20.066 -34.516 1.00 28.63 H new ATOM 0 HD21 LEU A 604 -0.651 17.473 -33.167 1.00 30.31 H new ATOM 0 HD22 LEU A 604 0.374 17.636 -34.364 1.00 30.31 H new ATOM 0 HD23 LEU A 604 0.868 17.070 -32.970 1.00 30.31 H new ATOM 1962 N MET A 605 3.639 20.740 -30.801 1.00 24.81 N ATOM 1963 CA MET A 605 3.857 20.969 -29.361 1.00 24.01 C ATOM 1964 C MET A 605 3.780 22.460 -29.056 1.00 26.68 C ATOM 1965 O MET A 605 3.131 22.853 -28.085 1.00 25.02 O ATOM 1966 CB MET A 605 5.254 20.478 -28.907 1.00 25.60 C ATOM 1967 CG MET A 605 5.417 18.996 -28.852 1.00 27.82 C ATOM 1968 SD MET A 605 7.139 18.615 -28.405 1.00 29.40 S ATOM 1969 CE MET A 605 7.311 17.090 -29.203 1.00 26.70 C ATOM 0 H MET A 605 4.292 20.329 -31.181 1.00 24.81 H new ATOM 0 HA MET A 605 3.169 20.474 -28.888 1.00 24.01 H new ATOM 0 HB2 MET A 605 5.921 20.841 -29.511 1.00 25.60 H new ATOM 0 HB3 MET A 605 5.440 20.843 -28.028 1.00 25.60 H new ATOM 0 HG2 MET A 605 4.808 18.615 -28.200 1.00 27.82 H new ATOM 0 HG3 MET A 605 5.197 18.601 -29.710 1.00 27.82 H new ATOM 0 HE1 MET A 605 8.205 16.746 -29.054 1.00 26.70 H new ATOM 0 HE2 MET A 605 6.661 16.464 -28.848 1.00 26.70 H new ATOM 0 HE3 MET A 605 7.164 17.204 -30.155 1.00 26.70 H new ATOM 1970 N ASN A 606 4.502 23.298 -29.853 1.00 24.33 N ATOM 1971 CA ASN A 606 4.496 24.750 -29.660 1.00 24.47 C ATOM 1972 C ASN A 606 3.094 25.366 -29.822 1.00 27.53 C ATOM 1973 O ASN A 606 2.747 26.283 -29.082 1.00 28.20 O ATOM 1974 CB ASN A 606 5.532 25.449 -30.554 1.00 26.13 C ATOM 1975 CG ASN A 606 6.871 25.553 -29.900 1.00 39.55 C ATOM 1976 OD1 ASN A 606 7.034 26.167 -28.849 1.00 25.94 O ATOM 1977 ND2 ASN A 606 7.861 24.919 -30.487 1.00 41.39 N ATOM 0 H ASN A 606 4.995 23.031 -30.505 1.00 24.33 H new ATOM 0 HA ASN A 606 4.757 24.903 -28.739 1.00 24.47 H new ATOM 0 HB2 ASN A 606 5.619 24.960 -31.387 1.00 26.13 H new ATOM 0 HB3 ASN A 606 5.215 26.338 -30.779 1.00 26.13 H new ATOM 0 HD21 ASN A 606 8.646 24.928 -30.135 1.00 41.39 H new ATOM 0 HD22 ASN A 606 7.724 24.495 -31.223 1.00 41.39 H new ATOM 1978 N LEU A 607 2.299 24.849 -30.762 1.00 24.49 N ATOM 1979 CA LEU A 607 0.933 25.313 -30.998 1.00 25.57 C ATOM 1980 C LEU A 607 0.012 24.945 -29.808 1.00 28.01 C ATOM 1981 O LEU A 607 -0.806 25.775 -29.412 1.00 26.81 O ATOM 1982 CB LEU A 607 0.416 24.814 -32.357 1.00 26.99 C ATOM 1983 CG LEU A 607 -0.992 25.243 -32.795 1.00 34.82 C ATOM 1984 CD1 LEU A 607 -1.060 26.744 -33.150 1.00 36.24 C ATOM 1985 CD2 LEU A 607 -1.464 24.413 -33.965 1.00 38.94 C ATOM 0 H LEU A 607 2.543 24.212 -31.286 1.00 24.49 H new ATOM 0 HA LEU A 607 0.929 26.282 -31.048 1.00 25.57 H new ATOM 0 HB2 LEU A 607 1.041 25.107 -33.038 1.00 26.99 H new ATOM 0 HB3 LEU A 607 0.441 23.844 -32.347 1.00 26.99 H new ATOM 0 HG LEU A 607 -1.581 25.092 -32.039 1.00 34.82 H new ATOM 0 HD11 LEU A 607 -1.963 26.972 -33.420 1.00 36.24 H new ATOM 0 HD12 LEU A 607 -0.812 27.272 -32.375 1.00 36.24 H new ATOM 0 HD13 LEU A 607 -0.448 26.933 -33.878 1.00 36.24 H new ATOM 0 HD21 LEU A 607 -2.353 24.698 -34.227 1.00 38.94 H new ATOM 0 HD22 LEU A 607 -0.855 24.529 -34.711 1.00 38.94 H new ATOM 0 HD23 LEU A 607 -1.487 23.477 -33.710 1.00 38.94 H new ATOM 1986 N CYS A 608 0.225 23.753 -29.168 1.00 24.20 N ATOM 1987 CA CYS A 608 -0.492 23.342 -27.933 1.00 22.28 C ATOM 1988 C CYS A 608 -0.093 24.298 -26.793 1.00 25.09 C ATOM 1989 O CYS A 608 -0.868 24.513 -25.854 1.00 24.08 O ATOM 1990 CB CYS A 608 -0.163 21.896 -27.563 1.00 21.84 C ATOM 1991 SG CYS A 608 -0.822 20.653 -28.708 1.00 24.88 S ATOM 0 H CYS A 608 0.791 23.168 -29.446 1.00 24.20 H new ATOM 0 HA CYS A 608 -1.449 23.391 -28.084 1.00 22.28 H new ATOM 0 HB2 CYS A 608 0.801 21.798 -27.518 1.00 21.84 H new ATOM 0 HB3 CYS A 608 -0.509 21.715 -26.675 1.00 21.84 H new ATOM 0 HG CYS A 608 -0.230 20.714 -29.750 1.00 24.88 H new ATOM 1992 N TRP A 609 1.140 24.847 -26.869 1.00 22.02 N ATOM 1993 CA TRP A 609 1.689 25.784 -25.884 1.00 21.69 C ATOM 1994 C TRP A 609 1.404 27.282 -26.198 1.00 24.99 C ATOM 1995 O TRP A 609 2.166 28.159 -25.781 1.00 25.52 O ATOM 1996 CB TRP A 609 3.182 25.513 -25.572 1.00 20.58 C ATOM 1997 CG TRP A 609 3.520 24.111 -25.121 1.00 21.16 C ATOM 1998 CD1 TRP A 609 2.741 23.257 -24.391 1.00 23.85 C ATOM 1999 CD2 TRP A 609 4.763 23.428 -25.346 1.00 21.01 C ATOM 2000 NE1 TRP A 609 3.419 22.074 -24.159 1.00 22.44 N ATOM 2001 CE2 TRP A 609 4.672 22.164 -24.713 1.00 24.01 C ATOM 2002 CE3 TRP A 609 5.953 23.764 -26.031 1.00 22.09 C ATOM 2003 CZ2 TRP A 609 5.716 21.222 -24.765 1.00 22.68 C ATOM 2004 CZ3 TRP A 609 6.996 22.841 -26.060 1.00 23.63 C ATOM 2005 CH2 TRP A 609 6.870 21.583 -25.440 1.00 23.75 C ATOM 0 H TRP A 609 1.685 24.675 -27.512 1.00 22.02 H new ATOM 0 HA TRP A 609 1.196 25.604 -25.068 1.00 21.69 H new ATOM 0 HB2 TRP A 609 3.702 25.712 -26.367 1.00 20.58 H new ATOM 0 HB3 TRP A 609 3.468 26.133 -24.883 1.00 20.58 H new ATOM 0 HD1 TRP A 609 1.880 23.444 -24.094 1.00 23.85 H new ATOM 0 HE1 TRP A 609 3.107 21.393 -23.737 1.00 22.44 H new ATOM 0 HE3 TRP A 609 6.038 24.587 -26.455 1.00 22.09 H new ATOM 0 HZ2 TRP A 609 5.634 20.388 -24.361 1.00 22.68 H new ATOM 0 HZ3 TRP A 609 7.788 23.059 -26.496 1.00 23.63 H new ATOM 0 HH2 TRP A 609 7.578 20.981 -25.485 1.00 23.75 H new ATOM 2006 N THR A 610 0.271 27.572 -26.869 1.00 23.60 N ATOM 2007 CA THR A 610 -0.201 28.942 -27.119 1.00 23.41 C ATOM 2008 C THR A 610 -0.602 29.504 -25.753 1.00 27.07 C ATOM 2009 O THR A 610 -1.424 28.888 -25.061 1.00 26.10 O ATOM 2010 CB THR A 610 -1.362 28.955 -28.127 1.00 29.61 C ATOM 2011 OG1 THR A 610 -0.877 28.447 -29.358 1.00 28.37 O ATOM 2012 CG2 THR A 610 -1.961 30.379 -28.359 1.00 25.07 C ATOM 0 H THR A 610 -0.247 26.967 -27.193 1.00 23.60 H new ATOM 0 HA THR A 610 0.488 29.493 -27.522 1.00 23.41 H new ATOM 0 HB THR A 610 -2.077 28.409 -27.765 1.00 29.61 H new ATOM 0 HG1 THR A 610 -0.883 27.607 -29.337 1.00 28.37 H new ATOM 0 HG21 THR A 610 -2.686 30.325 -29.001 1.00 25.07 H new ATOM 0 HG22 THR A 610 -2.299 30.729 -27.520 1.00 25.07 H new ATOM 0 HG23 THR A 610 -1.271 30.969 -28.700 1.00 25.07 H new ATOM 2013 N TYR A 611 0.022 30.629 -25.344 1.00 24.71 N ATOM 2014 CA TYR A 611 -0.226 31.279 -24.042 1.00 26.11 C ATOM 2015 C TYR A 611 -1.706 31.629 -23.835 1.00 31.13 C ATOM 2016 O TYR A 611 -2.261 31.354 -22.763 1.00 31.29 O ATOM 2017 CB TYR A 611 0.640 32.547 -23.856 1.00 26.81 C ATOM 2018 CG TYR A 611 0.574 33.131 -22.460 1.00 25.01 C ATOM 2019 CD1 TYR A 611 1.463 32.727 -21.472 1.00 25.34 C ATOM 2020 CD2 TYR A 611 -0.375 34.102 -22.128 1.00 25.94 C ATOM 2021 CE1 TYR A 611 1.386 33.231 -20.177 1.00 24.00 C ATOM 2022 CE2 TYR A 611 -0.459 34.618 -20.834 1.00 26.52 C ATOM 2023 CZ TYR A 611 0.411 34.169 -19.859 1.00 30.63 C ATOM 2024 OH TYR A 611 0.346 34.683 -18.584 1.00 30.29 O ATOM 0 H TYR A 611 0.607 31.038 -25.823 1.00 24.71 H new ATOM 0 HA TYR A 611 0.028 30.627 -23.370 1.00 26.11 H new ATOM 0 HB2 TYR A 611 1.563 32.332 -24.065 1.00 26.81 H new ATOM 0 HB3 TYR A 611 0.354 33.220 -24.493 1.00 26.81 H new ATOM 0 HD1 TYR A 611 2.124 32.107 -21.680 1.00 25.34 H new ATOM 0 HD2 TYR A 611 -0.961 34.410 -22.781 1.00 25.94 H new ATOM 0 HE1 TYR A 611 1.985 32.941 -19.527 1.00 24.00 H new ATOM 0 HE2 TYR A 611 -1.098 35.262 -20.629 1.00 26.52 H new ATOM 0 HH TYR A 611 -0.286 35.235 -18.536 1.00 30.29 H new ATOM 2025 N ASP A 612 -2.323 32.253 -24.847 1.00 27.69 N ATOM 2026 CA ASP A 612 -3.706 32.684 -24.760 1.00 27.98 C ATOM 2027 C ASP A 612 -4.660 31.586 -25.173 1.00 29.32 C ATOM 2028 O ASP A 612 -4.678 31.163 -26.331 1.00 27.72 O ATOM 2029 CB ASP A 612 -3.947 34.004 -25.529 1.00 29.93 C ATOM 2030 CG ASP A 612 -5.361 34.572 -25.402 1.00 41.13 C ATOM 2031 OD1 ASP A 612 -6.115 34.120 -24.502 1.00 41.74 O ATOM 2032 OD2 ASP A 612 -5.715 35.456 -26.202 1.00 49.97 O1- ATOM 0 H ASP A 612 -1.944 32.434 -25.598 1.00 27.69 H new ATOM 0 HA ASP A 612 -3.893 32.875 -23.827 1.00 27.98 H new ATOM 0 HB2 ASP A 612 -3.316 34.668 -25.211 1.00 29.93 H new ATOM 0 HB3 ASP A 612 -3.755 33.856 -26.468 1.00 29.93 H new ATOM 2033 N VAL A 613 -5.453 31.131 -24.193 1.00 28.31 N ATOM 2034 CA VAL A 613 -6.448 30.059 -24.297 1.00 29.59 C ATOM 2035 C VAL A 613 -7.414 30.251 -25.480 1.00 34.43 C ATOM 2036 O VAL A 613 -7.753 29.271 -26.150 1.00 34.47 O ATOM 2037 CB VAL A 613 -7.142 29.802 -22.912 1.00 34.57 C ATOM 2038 CG1 VAL A 613 -7.994 30.994 -22.454 1.00 34.62 C ATOM 2039 CG2 VAL A 613 -7.958 28.512 -22.911 1.00 34.55 C ATOM 0 H VAL A 613 -5.420 31.463 -23.401 1.00 28.31 H new ATOM 0 HA VAL A 613 -5.983 29.236 -24.516 1.00 29.59 H new ATOM 0 HB VAL A 613 -6.425 29.697 -22.267 1.00 34.57 H new ATOM 0 HG11 VAL A 613 -8.402 30.791 -21.598 1.00 34.62 H new ATOM 0 HG12 VAL A 613 -7.431 31.779 -22.366 1.00 34.62 H new ATOM 0 HG13 VAL A 613 -8.688 31.166 -23.109 1.00 34.62 H new ATOM 0 HG21 VAL A 613 -8.369 28.390 -22.041 1.00 34.55 H new ATOM 0 HG22 VAL A 613 -8.649 28.565 -23.590 1.00 34.55 H new ATOM 0 HG23 VAL A 613 -7.375 27.760 -23.101 1.00 34.55 H new ATOM 2040 N GLU A 614 -7.794 31.516 -25.782 1.00 32.44 N ATOM 2041 CA GLU A 614 -8.706 31.839 -26.894 1.00 33.29 C ATOM 2042 C GLU A 614 -8.154 31.476 -28.280 1.00 38.00 C ATOM 2043 O GLU A 614 -8.907 31.009 -29.137 1.00 38.86 O ATOM 2044 CB GLU A 614 -9.162 33.320 -26.840 1.00 34.98 C ATOM 2045 CG GLU A 614 -9.992 33.690 -25.613 1.00 47.04 C ATOM 2046 CD GLU A 614 -11.192 32.816 -25.280 1.00 73.96 C ATOM 2047 OE1 GLU A 614 -11.930 32.424 -26.212 1.00 72.08 O ATOM 2048 OE2 GLU A 614 -11.397 32.530 -24.078 1.00 71.43 O1- ATOM 0 H GLU A 614 -7.526 32.205 -25.343 1.00 32.44 H new ATOM 0 HA GLU A 614 -9.482 31.272 -26.765 1.00 33.29 H new ATOM 0 HB2 GLU A 614 -8.376 33.888 -26.867 1.00 34.98 H new ATOM 0 HB3 GLU A 614 -9.680 33.515 -27.636 1.00 34.98 H new ATOM 0 HG2 GLU A 614 -9.402 33.692 -24.843 1.00 47.04 H new ATOM 0 HG3 GLU A 614 -10.309 34.599 -25.730 1.00 47.04 H new ATOM 2049 N ASN A 615 -6.838 31.643 -28.475 1.00 34.11 N ATOM 2050 CA ASN A 615 -6.137 31.332 -29.727 1.00 33.76 C ATOM 2051 C ASN A 615 -5.503 29.925 -29.796 1.00 36.41 C ATOM 2052 O ASN A 615 -5.017 29.526 -30.852 1.00 37.20 O ATOM 2053 CB ASN A 615 -5.120 32.437 -30.043 1.00 35.32 C ATOM 2054 CG ASN A 615 -5.780 33.772 -30.287 1.00 50.22 C ATOM 2055 OD1 ASN A 615 -6.676 33.902 -31.128 1.00 44.32 O ATOM 2056 ND2 ASN A 615 -5.394 34.778 -29.518 1.00 39.41 N ATOM 0 H ASN A 615 -6.316 31.949 -27.864 1.00 34.11 H new ATOM 0 HA ASN A 615 -6.819 31.308 -30.416 1.00 33.76 H new ATOM 0 HB2 ASN A 615 -4.494 32.518 -29.306 1.00 35.32 H new ATOM 0 HB3 ASN A 615 -4.605 32.185 -30.826 1.00 35.32 H new ATOM 0 HD21 ASN A 615 -5.769 35.548 -29.596 1.00 39.41 H new ATOM 0 HD22 ASN A 615 -4.768 34.662 -28.940 1.00 39.41 H new ATOM 2057 N ARG A 616 -5.532 29.167 -28.688 1.00 30.27 N ATOM 2058 CA ARG A 616 -4.985 27.804 -28.638 1.00 27.86 C ATOM 2059 C ARG A 616 -5.947 26.835 -29.386 1.00 30.04 C ATOM 2060 O ARG A 616 -7.157 26.987 -29.244 1.00 28.55 O ATOM 2061 CB ARG A 616 -4.815 27.395 -27.159 1.00 26.46 C ATOM 2062 CG ARG A 616 -4.038 26.083 -26.908 1.00 24.79 C ATOM 2063 CD ARG A 616 -3.994 25.716 -25.429 1.00 24.89 C ATOM 2064 NE ARG A 616 -3.449 26.806 -24.613 1.00 20.05 N ATOM 2065 CZ ARG A 616 -3.869 27.127 -23.397 1.00 27.20 C ATOM 2066 NH1 ARG A 616 -4.833 26.423 -22.811 1.00 19.15 N ATOM 2067 NH2 ARG A 616 -3.350 28.169 -22.766 1.00 19.26 N ATOM 0 H ARG A 616 -5.871 29.432 -27.944 1.00 30.27 H new ATOM 0 HA ARG A 616 -4.120 27.764 -29.074 1.00 27.86 H new ATOM 0 HB2 ARG A 616 -4.361 28.114 -26.692 1.00 26.46 H new ATOM 0 HB3 ARG A 616 -5.696 27.310 -26.761 1.00 26.46 H new ATOM 0 HG2 ARG A 616 -4.454 25.362 -27.407 1.00 24.79 H new ATOM 0 HG3 ARG A 616 -3.133 26.175 -27.244 1.00 24.79 H new ATOM 0 HD2 ARG A 616 -4.888 25.499 -25.123 1.00 24.89 H new ATOM 0 HD3 ARG A 616 -3.452 24.920 -25.309 1.00 24.89 H new ATOM 0 HE ARG A 616 -2.809 27.272 -24.948 1.00 20.05 H new ATOM 0 HH11 ARG A 616 -5.188 25.755 -23.221 1.00 19.15 H new ATOM 0 HH12 ARG A 616 -5.102 26.635 -22.022 1.00 19.15 H new ATOM 0 HH21 ARG A 616 -2.738 28.640 -23.145 1.00 19.26 H new ATOM 0 HH22 ARG A 616 -3.625 28.375 -21.977 1.00 19.26 H new ATOM 2068 N PRO A 617 -5.475 25.847 -30.188 1.00 26.85 N ATOM 2069 CA PRO A 617 -6.428 24.923 -30.838 1.00 26.85 C ATOM 2070 C PRO A 617 -7.130 23.975 -29.854 1.00 29.09 C ATOM 2071 O PRO A 617 -6.653 23.787 -28.727 1.00 26.66 O ATOM 2072 CB PRO A 617 -5.538 24.122 -31.786 1.00 28.89 C ATOM 2073 CG PRO A 617 -4.193 24.102 -31.103 1.00 32.56 C ATOM 2074 CD PRO A 617 -4.074 25.478 -30.500 1.00 28.07 C ATOM 0 HA PRO A 617 -7.150 25.407 -31.269 1.00 26.85 H new ATOM 0 HB2 PRO A 617 -5.881 23.225 -31.920 1.00 28.89 H new ATOM 0 HB3 PRO A 617 -5.485 24.539 -32.660 1.00 28.89 H new ATOM 0 HG2 PRO A 617 -4.149 23.411 -30.424 1.00 32.56 H new ATOM 0 HG3 PRO A 617 -3.477 23.926 -31.733 1.00 32.56 H new ATOM 0 HD2 PRO A 617 -3.521 25.471 -29.703 1.00 28.07 H new ATOM 0 HD3 PRO A 617 -3.670 26.105 -31.120 1.00 28.07 H new ATOM 2075 N GLY A 618 -8.263 23.427 -30.299 1.00 25.98 N ATOM 2076 CA GLY A 618 -9.060 22.421 -29.596 1.00 25.48 C ATOM 2077 C GLY A 618 -8.580 21.048 -30.030 1.00 27.65 C ATOM 2078 O GLY A 618 -7.722 20.971 -30.916 1.00 28.91 O ATOM 0 H GLY A 618 -8.604 23.644 -31.058 1.00 25.98 H new ATOM 0 HA2 GLY A 618 -8.965 22.525 -28.636 1.00 25.48 H new ATOM 0 HA3 GLY A 618 -10.002 22.531 -29.802 1.00 25.48 H new ATOM 2079 N PHE A 619 -9.114 19.948 -29.439 1.00 20.53 N ATOM 2080 CA PHE A 619 -8.666 18.595 -29.806 1.00 20.98 C ATOM 2081 C PHE A 619 -9.054 18.138 -31.221 1.00 29.06 C ATOM 2082 O PHE A 619 -8.306 17.371 -31.830 1.00 27.73 O ATOM 2083 CB PHE A 619 -9.015 17.554 -28.736 1.00 21.47 C ATOM 2084 CG PHE A 619 -8.054 17.558 -27.570 1.00 20.60 C ATOM 2085 CD1 PHE A 619 -8.463 17.984 -26.314 1.00 22.89 C ATOM 2086 CD2 PHE A 619 -6.739 17.120 -27.728 1.00 20.95 C ATOM 2087 CE1 PHE A 619 -7.573 17.987 -25.237 1.00 23.53 C ATOM 2088 CE2 PHE A 619 -5.849 17.109 -26.647 1.00 23.08 C ATOM 2089 CZ PHE A 619 -6.278 17.524 -25.404 1.00 22.22 C ATOM 0 H PHE A 619 -9.726 19.972 -28.835 1.00 20.53 H new ATOM 0 HA PHE A 619 -7.699 18.665 -29.839 1.00 20.98 H new ATOM 0 HB2 PHE A 619 -9.913 17.723 -28.409 1.00 21.47 H new ATOM 0 HB3 PHE A 619 -9.021 16.672 -29.140 1.00 21.47 H new ATOM 0 HD1 PHE A 619 -9.339 18.270 -26.188 1.00 22.89 H new ATOM 0 HD2 PHE A 619 -6.449 16.831 -28.563 1.00 20.95 H new ATOM 0 HE1 PHE A 619 -7.850 18.300 -24.406 1.00 23.53 H new ATOM 0 HE2 PHE A 619 -4.972 16.823 -26.767 1.00 23.08 H new ATOM 0 HZ PHE A 619 -5.698 17.493 -24.678 1.00 22.22 H new ATOM 2090 N ALA A 620 -10.166 18.669 -31.777 1.00 28.24 N ATOM 2091 CA ALA A 620 -10.548 18.338 -33.159 1.00 28.87 C ATOM 2092 C ALA A 620 -9.438 18.770 -34.159 1.00 33.70 C ATOM 2093 O ALA A 620 -9.026 17.953 -34.983 1.00 34.60 O ATOM 2094 CB ALA A 620 -11.887 18.979 -33.513 1.00 29.75 C ATOM 0 H ALA A 620 -10.699 19.211 -31.375 1.00 28.24 H new ATOM 0 HA ALA A 620 -10.648 17.376 -33.226 1.00 28.87 H new ATOM 0 HB1 ALA A 620 -12.124 18.751 -34.426 1.00 29.75 H new ATOM 0 HB2 ALA A 620 -12.572 18.651 -32.910 1.00 29.75 H new ATOM 0 HB3 ALA A 620 -11.817 19.943 -33.428 1.00 29.75 H new ATOM 2095 N ALA A 621 -8.900 20.001 -34.021 1.00 30.70 N ATOM 2096 CA ALA A 621 -7.819 20.545 -34.863 1.00 31.30 C ATOM 2097 C ALA A 621 -6.519 19.773 -34.646 1.00 34.14 C ATOM 2098 O ALA A 621 -5.855 19.414 -35.622 1.00 33.90 O ATOM 2099 CB ALA A 621 -7.598 22.025 -34.550 1.00 32.66 C ATOM 0 H ALA A 621 -9.164 20.553 -33.417 1.00 30.70 H new ATOM 0 HA ALA A 621 -8.084 20.450 -35.791 1.00 31.30 H new ATOM 0 HB1 ALA A 621 -6.885 22.371 -35.109 1.00 32.66 H new ATOM 0 HB2 ALA A 621 -8.415 22.518 -34.725 1.00 32.66 H new ATOM 0 HB3 ALA A 621 -7.354 22.126 -33.617 1.00 32.66 H new ATOM 2100 N VAL A 622 -6.166 19.492 -33.368 1.00 28.82 N ATOM 2101 CA VAL A 622 -4.950 18.741 -32.990 1.00 27.61 C ATOM 2102 C VAL A 622 -4.967 17.298 -33.526 1.00 30.75 C ATOM 2103 O VAL A 622 -3.960 16.864 -34.093 1.00 30.87 O ATOM 2104 CB VAL A 622 -4.661 18.807 -31.461 1.00 30.82 C ATOM 2105 CG1 VAL A 622 -3.509 17.888 -31.061 1.00 31.13 C ATOM 2106 CG2 VAL A 622 -4.383 20.241 -31.014 1.00 30.06 C ATOM 0 H VAL A 622 -6.637 19.738 -32.692 1.00 28.82 H new ATOM 0 HA VAL A 622 -4.205 19.186 -33.424 1.00 27.61 H new ATOM 0 HB VAL A 622 -5.459 18.494 -31.007 1.00 30.82 H new ATOM 0 HG11 VAL A 622 -3.358 17.955 -30.105 1.00 31.13 H new ATOM 0 HG12 VAL A 622 -3.731 16.972 -31.289 1.00 31.13 H new ATOM 0 HG13 VAL A 622 -2.705 18.152 -31.534 1.00 31.13 H new ATOM 0 HG21 VAL A 622 -4.207 20.254 -30.060 1.00 30.06 H new ATOM 0 HG22 VAL A 622 -3.611 20.585 -31.490 1.00 30.06 H new ATOM 0 HG23 VAL A 622 -5.155 20.796 -31.207 1.00 30.06 H new ATOM 2107 N GLU A 623 -6.086 16.554 -33.327 1.00 27.14 N ATOM 2108 CA GLU A 623 -6.231 15.169 -33.820 1.00 26.81 C ATOM 2109 C GLU A 623 -6.113 15.125 -35.351 1.00 32.11 C ATOM 2110 O GLU A 623 -5.477 14.206 -35.873 1.00 31.01 O ATOM 2111 CB GLU A 623 -7.569 14.541 -33.351 1.00 27.69 C ATOM 2112 CG GLU A 623 -7.789 13.080 -33.740 1.00 26.84 C ATOM 2113 CD GLU A 623 -8.233 12.785 -35.168 1.00 43.34 C ATOM 2114 OE1 GLU A 623 -8.880 13.653 -35.796 1.00 37.57 O ATOM 2115 OE2 GLU A 623 -7.904 11.689 -35.671 1.00 40.25 O1- ATOM 0 H GLU A 623 -6.776 16.844 -32.903 1.00 27.14 H new ATOM 0 HA GLU A 623 -5.510 14.641 -33.442 1.00 26.81 H new ATOM 0 HB2 GLU A 623 -7.619 14.612 -32.385 1.00 27.69 H new ATOM 0 HB3 GLU A 623 -8.299 15.068 -33.713 1.00 27.69 H new ATOM 0 HG2 GLU A 623 -6.961 12.601 -33.580 1.00 26.84 H new ATOM 0 HG3 GLU A 623 -8.453 12.708 -33.138 1.00 26.84 H new ATOM 2116 N LEU A 624 -6.754 16.074 -36.065 1.00 30.75 N ATOM 2117 CA LEU A 624 -6.694 16.110 -37.539 1.00 31.98 C ATOM 2118 C LEU A 624 -5.246 16.298 -38.029 1.00 34.88 C ATOM 2119 O LEU A 624 -4.795 15.558 -38.915 1.00 34.04 O ATOM 2120 CB LEU A 624 -7.646 17.185 -38.121 1.00 32.51 C ATOM 2121 CG LEU A 624 -7.768 17.267 -39.664 1.00 38.79 C ATOM 2122 CD1 LEU A 624 -8.358 15.988 -40.262 1.00 39.70 C ATOM 2123 CD2 LEU A 624 -8.600 18.477 -40.088 1.00 42.51 C ATOM 0 H LEU A 624 -7.226 16.701 -35.714 1.00 30.75 H new ATOM 0 HA LEU A 624 -7.003 15.252 -37.870 1.00 31.98 H new ATOM 0 HB2 LEU A 624 -8.532 17.030 -37.758 1.00 32.51 H new ATOM 0 HB3 LEU A 624 -7.354 18.051 -37.797 1.00 32.51 H new ATOM 0 HG LEU A 624 -6.868 17.370 -40.010 1.00 38.79 H new ATOM 0 HD11 LEU A 624 -8.418 16.079 -41.226 1.00 39.70 H new ATOM 0 HD12 LEU A 624 -7.787 15.235 -40.043 1.00 39.70 H new ATOM 0 HD13 LEU A 624 -9.244 15.838 -39.896 1.00 39.70 H new ATOM 0 HD21 LEU A 624 -8.661 18.505 -41.056 1.00 42.51 H new ATOM 0 HD22 LEU A 624 -9.491 18.406 -39.710 1.00 42.51 H new ATOM 0 HD23 LEU A 624 -8.177 19.289 -39.767 1.00 42.51 H new ATOM 2124 N ARG A 625 -4.511 17.246 -37.413 1.00 31.74 N ATOM 2125 CA ARG A 625 -3.097 17.508 -37.715 1.00 32.36 C ATOM 2126 C ARG A 625 -2.235 16.286 -37.491 1.00 34.82 C ATOM 2127 O ARG A 625 -1.378 16.003 -38.325 1.00 34.37 O ATOM 2128 CB ARG A 625 -2.547 18.718 -36.943 1.00 33.26 C ATOM 2129 CG ARG A 625 -2.500 19.969 -37.814 1.00 49.33 C ATOM 2130 CD ARG A 625 -1.652 21.077 -37.229 1.00 62.26 C ATOM 2131 NE ARG A 625 -0.217 20.799 -37.348 1.00 69.59 N ATOM 2132 CZ ARG A 625 0.742 21.683 -37.091 1.00 79.84 C ATOM 2133 NH1 ARG A 625 2.018 21.342 -37.217 1.00 64.18 N ATOM 2134 NH2 ARG A 625 0.434 22.917 -36.712 1.00 66.73 N ATOM 0 H ARG A 625 -4.830 17.759 -36.801 1.00 31.74 H new ATOM 0 HA ARG A 625 -3.059 17.728 -38.659 1.00 32.36 H new ATOM 0 HB2 ARG A 625 -3.102 18.886 -36.165 1.00 33.26 H new ATOM 0 HB3 ARG A 625 -1.656 18.516 -36.617 1.00 33.26 H new ATOM 0 HG2 ARG A 625 -2.153 19.733 -38.689 1.00 49.33 H new ATOM 0 HG3 ARG A 625 -3.403 20.297 -37.946 1.00 49.33 H new ATOM 0 HD2 ARG A 625 -1.857 21.911 -37.680 1.00 62.26 H new ATOM 0 HD3 ARG A 625 -1.880 21.197 -36.294 1.00 62.26 H new ATOM 0 HE ARG A 625 0.020 20.012 -37.601 1.00 69.59 H new ATOM 0 HH11 ARG A 625 2.228 20.546 -37.466 1.00 64.18 H new ATOM 0 HH12 ARG A 625 2.635 21.917 -37.050 1.00 64.18 H new ATOM 0 HH21 ARG A 625 -0.390 23.149 -36.631 1.00 66.73 H new ATOM 0 HH22 ARG A 625 1.059 23.485 -36.547 1.00 66.73 H new ATOM 2135 N LEU A 626 -2.471 15.546 -36.384 1.00 30.24 N ATOM 2136 CA LEU A 626 -1.752 14.312 -36.079 1.00 29.63 C ATOM 2137 C LEU A 626 -2.141 13.190 -37.024 1.00 35.02 C ATOM 2138 O LEU A 626 -1.291 12.375 -37.372 1.00 36.07 O ATOM 2139 CB LEU A 626 -2.020 13.852 -34.635 1.00 29.00 C ATOM 2140 CG LEU A 626 -1.033 14.317 -33.588 1.00 32.61 C ATOM 2141 CD1 LEU A 626 -1.560 14.064 -32.200 1.00 31.91 C ATOM 2142 CD2 LEU A 626 0.340 13.676 -33.775 1.00 32.35 C ATOM 0 H LEU A 626 -3.059 15.758 -35.793 1.00 30.24 H new ATOM 0 HA LEU A 626 -0.809 14.510 -36.188 1.00 29.63 H new ATOM 0 HB2 LEU A 626 -2.904 14.158 -34.377 1.00 29.00 H new ATOM 0 HB3 LEU A 626 -2.041 12.882 -34.624 1.00 29.00 H new ATOM 0 HG LEU A 626 -0.923 15.274 -33.702 1.00 32.61 H new ATOM 0 HD11 LEU A 626 -0.911 14.370 -31.547 1.00 31.91 H new ATOM 0 HD12 LEU A 626 -2.393 14.545 -32.077 1.00 31.91 H new ATOM 0 HD13 LEU A 626 -1.715 13.114 -32.081 1.00 31.91 H new ATOM 0 HD21 LEU A 626 0.944 13.997 -33.087 1.00 32.35 H new ATOM 0 HD22 LEU A 626 0.259 12.712 -33.708 1.00 32.35 H new ATOM 0 HD23 LEU A 626 0.691 13.911 -34.648 1.00 32.35 H new ATOM 2143 N ARG A 627 -3.424 13.119 -37.402 1.00 32.60 N ATOM 2144 CA ARG A 627 -3.934 12.075 -38.295 1.00 32.90 C ATOM 2145 C ARG A 627 -3.244 12.136 -39.659 1.00 38.53 C ATOM 2146 O ARG A 627 -2.757 11.113 -40.127 1.00 38.25 O ATOM 2147 CB ARG A 627 -5.449 12.210 -38.466 1.00 32.00 C ATOM 2148 CG ARG A 627 -6.115 10.971 -39.067 1.00 39.15 C ATOM 2149 CD ARG A 627 -7.468 11.301 -39.685 1.00 43.61 C ATOM 2150 NE ARG A 627 -8.400 11.881 -38.710 1.00 48.60 N ATOM 2151 CZ ARG A 627 -9.511 12.538 -39.030 1.00 59.55 C ATOM 2152 NH1 ARG A 627 -10.293 13.033 -38.079 1.00 36.51 N ATOM 2153 NH2 ARG A 627 -9.853 12.701 -40.304 1.00 46.45 N ATOM 0 H ARG A 627 -4.024 13.679 -37.145 1.00 32.60 H new ATOM 0 HA ARG A 627 -3.739 11.215 -37.892 1.00 32.90 H new ATOM 0 HB2 ARG A 627 -5.848 12.394 -37.602 1.00 32.00 H new ATOM 0 HB3 ARG A 627 -5.635 12.974 -39.033 1.00 32.00 H new ATOM 0 HG2 ARG A 627 -5.535 10.588 -39.743 1.00 39.15 H new ATOM 0 HG3 ARG A 627 -6.229 10.298 -38.377 1.00 39.15 H new ATOM 0 HD2 ARG A 627 -7.343 11.923 -40.419 1.00 43.61 H new ATOM 0 HD3 ARG A 627 -7.856 10.494 -40.059 1.00 43.61 H new ATOM 0 HE ARG A 627 -8.215 11.790 -37.875 1.00 48.60 H new ATOM 0 HH11 ARG A 627 -10.082 12.930 -37.252 1.00 36.51 H new ATOM 0 HH12 ARG A 627 -11.011 13.457 -38.290 1.00 36.51 H new ATOM 0 HH21 ARG A 627 -9.355 12.381 -40.927 1.00 46.45 H new ATOM 0 HH22 ARG A 627 -10.573 13.127 -40.505 1.00 46.45 H new ATOM 2154 N ASN A 628 -3.199 13.340 -40.272 1.00 36.73 N ATOM 2155 CA ASN A 628 -2.591 13.583 -41.581 1.00 36.83 C ATOM 2156 C ASN A 628 -1.094 13.379 -41.584 1.00 40.30 C ATOM 2157 O ASN A 628 -0.568 12.818 -42.552 1.00 40.33 O ATOM 2158 CB ASN A 628 -3.003 14.941 -42.148 1.00 37.42 C ATOM 2159 CG ASN A 628 -4.493 15.024 -42.421 1.00 47.42 C ATOM 2160 OD1 ASN A 628 -5.165 14.022 -42.695 1.00 42.41 O ATOM 2161 ND2 ASN A 628 -5.051 16.208 -42.308 1.00 35.34 N ATOM 0 H ASN A 628 -3.533 14.050 -39.920 1.00 36.73 H new ATOM 0 HA ASN A 628 -2.943 12.907 -42.181 1.00 36.83 H new ATOM 0 HB2 ASN A 628 -2.751 15.639 -41.524 1.00 37.42 H new ATOM 0 HB3 ASN A 628 -2.516 15.107 -42.970 1.00 37.42 H new ATOM 0 HD21 ASN A 628 -5.898 16.297 -42.425 1.00 35.34 H new ATOM 0 HD22 ASN A 628 -4.569 16.894 -42.117 1.00 35.34 H new ATOM 2162 N TYR A 629 -0.405 13.767 -40.486 1.00 34.30 N ATOM 2163 CA TYR A 629 1.031 13.539 -40.398 1.00 32.79 C ATOM 2164 C TYR A 629 1.352 12.047 -40.329 1.00 34.89 C ATOM 2165 O TYR A 629 2.266 11.588 -41.026 1.00 35.04 O ATOM 2166 CB TYR A 629 1.697 14.329 -39.254 1.00 33.42 C ATOM 2167 CG TYR A 629 3.207 14.262 -39.337 1.00 34.20 C ATOM 2168 CD1 TYR A 629 3.892 14.848 -40.398 1.00 35.88 C ATOM 2169 CD2 TYR A 629 3.950 13.571 -38.383 1.00 34.82 C ATOM 2170 CE1 TYR A 629 5.278 14.753 -40.507 1.00 36.86 C ATOM 2171 CE2 TYR A 629 5.346 13.510 -38.456 1.00 36.02 C ATOM 2172 CZ TYR A 629 6.003 14.092 -39.531 1.00 43.60 C ATOM 2173 OH TYR A 629 7.369 14.020 -39.657 1.00 44.72 O ATOM 0 H TYR A 629 -0.754 14.155 -39.802 1.00 34.30 H new ATOM 0 HA TYR A 629 1.418 13.886 -41.217 1.00 32.79 H new ATOM 0 HB2 TYR A 629 1.411 15.255 -39.290 1.00 33.42 H new ATOM 0 HB3 TYR A 629 1.403 13.974 -38.401 1.00 33.42 H new ATOM 0 HD1 TYR A 629 3.415 15.312 -41.047 1.00 35.88 H new ATOM 0 HD2 TYR A 629 3.510 13.142 -37.685 1.00 34.82 H new ATOM 0 HE1 TYR A 629 5.715 15.133 -41.235 1.00 36.86 H new ATOM 0 HE2 TYR A 629 5.831 13.082 -37.788 1.00 36.02 H new ATOM 0 HH TYR A 629 7.687 14.796 -39.710 1.00 44.72 H new ATOM 2174 N TYR A 630 0.575 11.290 -39.524 1.00 30.23 N ATOM 2175 CA TYR A 630 0.717 9.844 -39.362 1.00 30.92 C ATOM 2176 C TYR A 630 0.590 9.104 -40.696 1.00 37.25 C ATOM 2177 O TYR A 630 1.449 8.283 -41.003 1.00 36.10 O ATOM 2178 CB TYR A 630 -0.273 9.284 -38.321 1.00 32.52 C ATOM 2179 CG TYR A 630 -0.074 7.807 -38.061 1.00 34.62 C ATOM 2180 CD1 TYR A 630 1.156 7.313 -37.630 1.00 36.46 C ATOM 2181 CD2 TYR A 630 -1.106 6.896 -38.272 1.00 35.32 C ATOM 2182 CE1 TYR A 630 1.363 5.950 -37.438 1.00 36.35 C ATOM 2183 CE2 TYR A 630 -0.911 5.526 -38.079 1.00 36.19 C ATOM 2184 CZ TYR A 630 0.324 5.061 -37.652 1.00 42.60 C ATOM 2185 OH TYR A 630 0.539 3.724 -37.440 1.00 44.41 O ATOM 0 H TYR A 630 -0.061 11.622 -39.050 1.00 30.23 H new ATOM 0 HA TYR A 630 1.614 9.689 -39.027 1.00 30.92 H new ATOM 0 HB2 TYR A 630 -0.171 9.772 -37.489 1.00 32.52 H new ATOM 0 HB3 TYR A 630 -1.180 9.435 -38.629 1.00 32.52 H new ATOM 0 HD1 TYR A 630 1.853 7.907 -37.467 1.00 36.46 H new ATOM 0 HD2 TYR A 630 -1.939 7.205 -38.546 1.00 35.32 H new ATOM 0 HE1 TYR A 630 2.196 5.638 -37.167 1.00 36.35 H new ATOM 0 HE2 TYR A 630 -1.606 4.929 -38.236 1.00 36.19 H new ATOM 0 HH TYR A 630 -0.166 3.297 -37.604 1.00 44.41 H new ATOM 2186 N TYR A 631 -0.431 9.452 -41.516 1.00 36.74 N ATOM 2187 CA TYR A 631 -0.647 8.854 -42.839 1.00 38.25 C ATOM 2188 C TYR A 631 0.528 9.152 -43.785 1.00 45.03 C ATOM 2189 O TYR A 631 0.932 8.267 -44.547 1.00 45.63 O ATOM 2190 CB TYR A 631 -1.991 9.304 -43.453 1.00 40.66 C ATOM 2191 CG TYR A 631 -3.238 8.930 -42.667 1.00 44.23 C ATOM 2192 CD1 TYR A 631 -3.228 7.873 -41.759 1.00 46.35 C ATOM 2193 CD2 TYR A 631 -4.438 9.608 -42.864 1.00 45.78 C ATOM 2194 CE1 TYR A 631 -4.367 7.534 -41.032 1.00 48.10 C ATOM 2195 CE2 TYR A 631 -5.593 9.251 -42.173 1.00 46.84 C ATOM 2196 CZ TYR A 631 -5.553 8.217 -41.253 1.00 56.13 C ATOM 2197 OH TYR A 631 -6.689 7.883 -40.552 1.00 58.53 O ATOM 0 H TYR A 631 -1.016 10.047 -41.309 1.00 36.74 H new ATOM 0 HA TYR A 631 -0.691 7.892 -42.719 1.00 38.25 H new ATOM 0 HB2 TYR A 631 -1.972 10.268 -43.557 1.00 40.66 H new ATOM 0 HB3 TYR A 631 -2.064 8.924 -44.342 1.00 40.66 H new ATOM 0 HD1 TYR A 631 -2.446 7.385 -41.636 1.00 46.35 H new ATOM 0 HD2 TYR A 631 -4.469 10.313 -43.469 1.00 45.78 H new ATOM 0 HE1 TYR A 631 -4.332 6.852 -40.401 1.00 48.10 H new ATOM 0 HE2 TYR A 631 -6.389 9.706 -42.329 1.00 46.84 H new ATOM 0 HH TYR A 631 -7.322 8.380 -40.791 1.00 58.53 H new ATOM 2198 N ASP A 632 1.096 10.381 -43.702 1.00 41.82 N ATOM 2199 CA ASP A 632 2.272 10.818 -44.459 1.00 42.60 C ATOM 2200 C ASP A 632 3.490 9.958 -44.097 1.00 47.98 C ATOM 2201 O ASP A 632 4.216 9.511 -44.995 1.00 48.87 O ATOM 2202 CB ASP A 632 2.588 12.292 -44.153 1.00 45.06 C ATOM 2203 CG ASP A 632 2.214 13.297 -45.221 1.00 60.03 C ATOM 2204 OD1 ASP A 632 1.699 12.876 -46.285 1.00 61.86 O ATOM 2205 OD2 ASP A 632 2.459 14.501 -45.007 1.00 66.85 O1- ATOM 0 H ASP A 632 0.788 10.994 -43.183 1.00 41.82 H new ATOM 0 HA ASP A 632 2.077 10.719 -45.404 1.00 42.60 H new ATOM 0 HB2 ASP A 632 2.132 12.537 -43.333 1.00 45.06 H new ATOM 0 HB3 ASP A 632 3.540 12.370 -43.983 1.00 45.06 H new ATOM 2206 N VAL A 633 3.705 9.721 -42.781 1.00 43.17 N ATOM 2207 CA VAL A 633 4.791 8.891 -42.267 1.00 42.86 C ATOM 2208 C VAL A 633 4.606 7.440 -42.741 1.00 47.05 C ATOM 2209 O VAL A 633 5.561 6.863 -43.256 1.00 46.50 O ATOM 2210 CB VAL A 633 4.995 9.034 -40.725 1.00 46.31 C ATOM 2211 CG1 VAL A 633 5.978 7.997 -40.187 1.00 45.86 C ATOM 2212 CG2 VAL A 633 5.474 10.441 -40.369 1.00 45.93 C ATOM 0 H VAL A 633 3.207 10.050 -42.162 1.00 43.17 H new ATOM 0 HA VAL A 633 5.626 9.214 -42.639 1.00 42.86 H new ATOM 0 HB VAL A 633 4.134 8.878 -40.306 1.00 46.31 H new ATOM 0 HG11 VAL A 633 6.081 8.114 -39.230 1.00 45.86 H new ATOM 0 HG12 VAL A 633 5.640 7.106 -40.369 1.00 45.86 H new ATOM 0 HG13 VAL A 633 6.838 8.111 -40.620 1.00 45.86 H new ATOM 0 HG21 VAL A 633 5.594 10.509 -39.409 1.00 45.93 H new ATOM 0 HG22 VAL A 633 6.318 10.618 -40.814 1.00 45.93 H new ATOM 0 HG23 VAL A 633 4.814 11.091 -40.658 1.00 45.93 H new ATOM 2213 N VAL A 634 3.372 6.890 -42.628 1.00 44.64 N ATOM 2214 CA VAL A 634 3.002 5.536 -43.074 1.00 45.66 C ATOM 2215 C VAL A 634 3.399 5.320 -44.559 1.00 52.98 C ATOM 2216 O VAL A 634 4.040 4.313 -44.866 1.00 52.62 O ATOM 2217 CB VAL A 634 1.507 5.206 -42.759 1.00 49.64 C ATOM 2218 CG1 VAL A 634 0.990 4.011 -43.564 1.00 49.40 C ATOM 2219 CG2 VAL A 634 1.300 4.965 -41.264 1.00 49.46 C ATOM 0 H VAL A 634 2.712 7.316 -42.277 1.00 44.64 H new ATOM 0 HA VAL A 634 3.512 4.890 -42.561 1.00 45.66 H new ATOM 0 HB VAL A 634 0.991 5.982 -43.027 1.00 49.64 H new ATOM 0 HG11 VAL A 634 0.062 3.844 -43.336 1.00 49.40 H new ATOM 0 HG12 VAL A 634 1.060 4.204 -44.512 1.00 49.40 H new ATOM 0 HG13 VAL A 634 1.520 3.226 -43.355 1.00 49.40 H new ATOM 0 HG21 VAL A 634 0.367 4.763 -41.095 1.00 49.46 H new ATOM 0 HG22 VAL A 634 1.849 4.219 -40.977 1.00 49.46 H new ATOM 0 HG23 VAL A 634 1.553 5.760 -40.770 1.00 49.46 H new ATOM 2220 N ASN A 635 3.097 6.309 -45.440 1.00 51.79 N ATOM 2221 CA ASN A 635 3.426 6.308 -46.873 1.00 52.73 C ATOM 2222 C ASN A 635 4.939 6.246 -47.162 1.00 60.39 C ATOM 2223 O ASN A 635 5.344 5.638 -48.155 1.00 60.40 O ATOM 2224 CB ASN A 635 2.795 7.515 -47.583 1.00 51.42 C ATOM 2225 CG ASN A 635 2.856 7.475 -49.106 1.00 68.98 C ATOM 2226 OD1 ASN A 635 2.806 6.281 -49.696 1.00 55.56 O flip ATOM 2227 ND2 ASN A 635 2.931 8.514 -49.776 1.00 59.99 N flip ATOM 0 H ASN A 635 2.679 7.021 -45.199 1.00 51.79 H new ATOM 0 HA ASN A 635 3.046 5.490 -47.229 1.00 52.73 H new ATOM 0 HB2 ASN A 635 1.866 7.582 -47.312 1.00 51.42 H new ATOM 0 HB3 ASN A 635 3.239 8.321 -47.277 1.00 51.42 H new ATOM 0 HD21 ASN A 635 2.963 9.278 -49.383 1.00 59.99 H new ATOM 0 HD22 ASN A 635 2.951 8.471 -50.635 1.00 59.99 H new ATOM 2228 N HIS A 636 5.764 6.881 -46.311 1.00 59.21 N ATOM 2229 CA HIS A 636 7.222 6.861 -46.446 1.00 65.88 C ATOM 2230 C HIS A 636 7.778 5.509 -45.977 1.00 65.00 C ATOM 2231 O HIS A 636 8.685 4.976 -46.646 1.00 68.10 O ATOM 2232 CB HIS A 636 7.855 8.019 -45.658 1.00 67.41 C ATOM 2233 CG HIS A 636 7.986 9.290 -46.442 1.00 71.52 C ATOM 2234 ND1 HIS A 636 6.871 10.000 -46.864 1.00 73.65 N ATOM 2235 CD2 HIS A 636 9.101 9.953 -46.833 1.00 73.70 C ATOM 2236 CE1 HIS A 636 7.341 11.059 -47.506 1.00 73.25 C ATOM 2237 NE2 HIS A 636 8.677 11.075 -47.515 1.00 73.59 N ATOM 0 H HIS A 636 5.485 7.337 -45.637 1.00 59.21 H new ATOM 0 HA HIS A 636 7.450 6.978 -47.382 1.00 65.88 H new ATOM 0 HB2 HIS A 636 7.320 8.191 -44.868 1.00 67.41 H new ATOM 0 HB3 HIS A 636 8.734 7.747 -45.351 1.00 67.41 H new ATOM 0 HD2 HIS A 636 9.982 9.701 -46.673 1.00 73.70 H new ATOM 0 HE1 HIS A 636 6.808 11.710 -47.901 1.00 73.25 H new ATOM 0 HE2 HIS A 636 9.178 11.672 -47.878 1.00 73.59 H new TER 2238 HIS A 636 ATOM 2239 N GLU B 346 7.496 16.176 -6.378 1.00 51.48 N ATOM 2240 CA GLU B 346 8.182 16.546 -7.622 1.00 51.27 C ATOM 2241 C GLU B 346 7.225 16.641 -8.826 1.00 54.06 C ATOM 2242 O GLU B 346 7.510 17.362 -9.794 1.00 53.97 O ATOM 2243 CB GLU B 346 9.370 15.595 -7.911 1.00 52.67 C ATOM 2244 CG GLU B 346 9.040 14.254 -8.567 1.00 63.90 C ATOM 2245 CD GLU B 346 8.280 13.201 -7.778 1.00 90.39 C ATOM 2246 OE1 GLU B 346 8.113 13.358 -6.546 1.00 96.40 O ATOM 2247 OE2 GLU B 346 7.875 12.191 -8.398 1.00 83.81 O1- ATOM 0 HA GLU B 346 8.538 17.438 -7.488 1.00 51.27 H new ATOM 0 HB2 GLU B 346 9.999 16.063 -8.482 1.00 52.67 H new ATOM 0 HB3 GLU B 346 9.825 15.417 -7.073 1.00 52.67 H new ATOM 0 HG2 GLU B 346 8.528 14.441 -9.369 1.00 63.90 H new ATOM 0 HG3 GLU B 346 9.878 13.856 -8.851 1.00 63.90 H new ATOM 2248 N VAL B 347 6.113 15.890 -8.766 1.00 48.16 N ATOM 2249 CA VAL B 347 5.094 15.859 -9.811 1.00 47.15 C ATOM 2250 C VAL B 347 3.903 16.709 -9.374 1.00 49.69 C ATOM 2251 O VAL B 347 3.461 17.562 -10.131 1.00 48.38 O ATOM 2252 CB VAL B 347 4.715 14.399 -10.181 1.00 50.59 C ATOM 2253 CG1 VAL B 347 3.399 14.332 -10.940 1.00 50.14 C ATOM 2254 CG2 VAL B 347 5.834 13.735 -10.982 1.00 50.45 C ATOM 0 H VAL B 347 5.933 15.377 -8.100 1.00 48.16 H new ATOM 0 HA VAL B 347 5.443 16.247 -10.629 1.00 47.15 H new ATOM 0 HB VAL B 347 4.598 13.911 -9.351 1.00 50.59 H new ATOM 0 HG11 VAL B 347 3.195 13.408 -11.154 1.00 50.14 H new ATOM 0 HG12 VAL B 347 2.689 14.701 -10.391 1.00 50.14 H new ATOM 0 HG13 VAL B 347 3.472 14.845 -11.760 1.00 50.14 H new ATOM 0 HG21 VAL B 347 5.578 12.826 -11.203 1.00 50.45 H new ATOM 0 HG22 VAL B 347 5.988 14.235 -11.799 1.00 50.45 H new ATOM 0 HG23 VAL B 347 6.647 13.722 -10.453 1.00 50.45 H new HETATM 2255 N PTR B 348 3.407 16.488 -8.150 1.00 47.26 N HETATM 2256 CA PTR B 348 2.271 17.218 -7.590 1.00 48.19 C HETATM 2257 C PTR B 348 2.770 18.229 -6.574 1.00 54.06 C HETATM 2258 O PTR B 348 3.380 17.845 -5.571 1.00 54.34 O HETATM 2259 CB PTR B 348 1.317 16.286 -6.815 1.00 48.77 C HETATM 2260 CG PTR B 348 0.710 15.421 -7.825 1.00 50.12 C HETATM 2261 CD1 PTR B 348 1.224 14.132 -7.998 1.00 51.30 C HETATM 2262 CD2 PTR B 348 -0.326 15.927 -8.610 1.00 51.01 C HETATM 2263 CE1 PTR B 348 0.688 13.317 -8.979 1.00 52.48 C HETATM 2264 CE2 PTR B 348 -0.877 15.111 -9.584 1.00 52.24 C HETATM 2265 CZ PTR B 348 -0.390 13.814 -9.768 1.00 54.35 C HETATM 2266 OH PTR B 348 -0.993 13.119 -10.767 1.00 58.13 O HETATM 2267 P PTR B 348 -0.986 11.626 -10.633 1.00 61.68 P HETATM 2268 O1P PTR B 348 -1.299 11.179 -12.060 1.00 62.34 O1- HETATM 2269 O2P PTR B 348 0.387 11.136 -10.156 1.00 63.09 O1- HETATM 2270 O3P PTR B 348 -2.066 11.128 -9.636 1.00 62.34 O HETATM 0 HE2 PTR B 348 -1.601 15.440 -10.139 1.00 52.24 H new HETATM 0 HE1 PTR B 348 1.039 12.425 -9.127 1.00 52.48 H new HETATM 0 HD2 PTR B 348 -0.653 16.830 -8.477 1.00 51.01 H new HETATM 0 HD1 PTR B 348 1.948 13.813 -7.437 1.00 51.30 H new HETATM 0 HB3 PTR B 348 1.799 15.765 -6.153 1.00 48.77 H new HETATM 0 HB2 PTR B 348 0.642 16.795 -6.339 1.00 48.77 H new HETATM 0 HA PTR B 348 1.810 17.632 -8.336 1.00 48.19 H new ATOM 2271 N GLU B 349 2.520 19.515 -6.836 1.00 51.10 N ATOM 2272 CA GLU B 349 2.933 20.599 -5.949 1.00 51.96 C ATOM 2273 C GLU B 349 1.732 21.201 -5.221 1.00 58.87 C ATOM 2274 O GLU B 349 0.709 21.498 -5.848 1.00 57.55 O ATOM 2275 CB GLU B 349 3.670 21.698 -6.734 1.00 53.21 C ATOM 2276 CG GLU B 349 5.068 21.322 -7.196 1.00 63.28 C ATOM 2277 CD GLU B 349 5.920 22.483 -7.673 1.00 77.72 C ATOM 2278 OE1 GLU B 349 5.516 23.652 -7.473 1.00 65.82 O ATOM 2279 OE2 GLU B 349 7.014 22.222 -8.224 1.00 72.38 O1- ATOM 0 H GLU B 349 2.103 19.781 -7.539 1.00 51.10 H new ATOM 0 HA GLU B 349 3.538 20.223 -5.291 1.00 51.96 H new ATOM 0 HB2 GLU B 349 3.139 21.935 -7.511 1.00 53.21 H new ATOM 0 HB3 GLU B 349 3.729 22.491 -6.178 1.00 53.21 H new ATOM 0 HG2 GLU B 349 5.528 20.880 -6.465 1.00 63.28 H new ATOM 0 HG3 GLU B 349 4.993 20.676 -7.916 1.00 63.28 H new ATOM 2280 N SER B 350 1.875 21.397 -3.899 1.00 59.03 N ATOM 2281 CA SER B 350 0.857 22.009 -3.039 1.00 60.65 C ATOM 2282 C SER B 350 0.989 23.550 -3.108 1.00 66.51 C ATOM 2283 O SER B 350 2.091 24.036 -3.375 1.00 66.02 O ATOM 2284 CB SER B 350 1.028 21.528 -1.599 1.00 65.74 C ATOM 2285 OG SER B 350 -0.222 21.222 -1.004 1.00 77.10 O ATOM 0 H SER B 350 2.586 21.170 -3.472 1.00 59.03 H new ATOM 0 HA SER B 350 -0.025 21.749 -3.347 1.00 60.65 H new ATOM 0 HB2 SER B 350 1.596 20.742 -1.584 1.00 65.74 H new ATOM 0 HB3 SER B 350 1.477 22.213 -1.079 1.00 65.74 H new ATOM 0 HG SER B 350 -0.100 20.959 -0.215 1.00 77.10 H new ATOM 2286 N PRO B 351 -0.091 24.348 -2.893 1.00 64.71 N ATOM 2287 CA PRO B 351 0.068 25.815 -2.969 1.00 66.42 C ATOM 2288 C PRO B 351 0.685 26.453 -1.720 1.00 75.18 C ATOM 2289 O PRO B 351 0.625 25.841 -0.631 1.00 77.14 O ATOM 2290 CB PRO B 351 -1.355 26.310 -3.209 1.00 68.01 C ATOM 2291 CG PRO B 351 -2.212 25.298 -2.538 1.00 71.88 C ATOM 2292 CD PRO B 351 -1.489 23.976 -2.582 1.00 66.95 C ATOM 2293 OXT PRO B 351 1.195 27.590 -1.828 1.00 95.26 O1- ATOM 0 HA PRO B 351 0.695 26.063 -3.666 1.00 66.42 H new ATOM 0 HB2 PRO B 351 -1.491 27.194 -2.834 1.00 68.01 H new ATOM 0 HB3 PRO B 351 -1.554 26.371 -4.156 1.00 68.01 H new ATOM 0 HG2 PRO B 351 -2.389 25.558 -1.620 1.00 71.88 H new ATOM 0 HG3 PRO B 351 -3.071 25.230 -2.984 1.00 71.88 H new ATOM 0 HD2 PRO B 351 -1.553 23.507 -1.735 1.00 66.95 H new ATOM 0 HD3 PRO B 351 -1.860 23.390 -3.260 1.00 66.95 H new TER 2294 PRO B 351 HETATM 2295 N2 50H A 701 -1.876 0.266 -13.748 1.00 27.57 N HETATM 2296 C6 50H A 701 -4.007 1.343 -13.492 1.00 24.75 C HETATM 2297 C9 50H A 701 -2.926 5.104 -10.038 1.00 49.60 C HETATM 2298 C13 50H A 701 -2.838 3.144 -11.577 1.00 37.95 C HETATM 2299 C20 50H A 701 1.830 -2.883 -15.995 1.00 30.19 C HETATM 2300 C18 50H A 701 2.650 -2.088 -15.211 1.00 33.65 C HETATM 2301 C16 50H A 701 2.108 -1.052 -14.468 1.00 33.52 C HETATM 2302 C26 50H A 701 -1.006 3.597 -10.067 1.00 38.40 C HETATM 2303 C27 50H A 701 -0.345 2.490 -10.550 1.00 38.13 C HETATM 2304 C25 50H A 701 -0.935 1.720 -11.536 1.00 35.98 C HETATM 2305 C22 50H A 701 0.472 -2.622 -16.043 1.00 30.51 C HETATM 2306 C15 50H A 701 0.744 -0.804 -14.526 1.00 33.15 C HETATM 2307 C12 50H A 701 -5.523 -0.443 -16.105 1.00 22.53 C HETATM 2308 C14 50H A 701 -5.685 0.497 -15.112 1.00 23.04 C HETATM 2309 C10 50H A 701 -2.172 2.029 -12.065 1.00 33.15 C HETATM 2310 C11 50H A 701 -2.250 3.909 -10.577 1.00 42.87 C HETATM 2311 C17 50H A 701 -0.091 -1.588 -15.310 1.00 31.08 C HETATM 2312 C3 50H A 701 -3.633 -0.311 -15.145 1.00 23.45 C HETATM 2313 C5 50H A 701 -2.727 1.175 -13.131 1.00 28.74 C HETATM 2314 C1 50H A 701 -2.275 -0.471 -14.751 1.00 25.93 C HETATM 2315 C29 50H A 701 4.603 -2.832 -16.293 1.00 37.35 C HETATM 2316 C28 50H A 701 2.305 0.584 -12.809 1.00 33.91 C HETATM 2317 N7 50H A 701 -4.240 -0.942 -16.125 1.00 24.79 N HETATM 2318 N4 50H A 701 -4.464 0.561 -14.511 1.00 25.06 N HETATM 2319 N21 50H A 701 -4.297 5.098 -10.137 1.00 52.95 N HETATM 2320 N8 50H A 701 -1.488 -1.399 -15.424 1.00 27.79 N HETATM 2321 O19 50H A 701 -2.263 6.007 -9.545 1.00 52.62 O HETATM 2322 O24 50H A 701 4.031 -2.304 -15.095 1.00 38.44 O HETATM 2323 O23 50H A 701 2.997 -0.289 -13.700 1.00 34.69 O HETATM 2324 O HOH A 801 -16.006 24.688 -8.440 1.00 44.50 O HETATM 2325 O HOH A 802 10.473 17.739 -13.837 1.00 37.73 O HETATM 2326 O HOH A 803 -1.592 13.010 -44.877 1.00 42.83 O HETATM 2327 O HOH A 804 -22.713 -12.176 -8.156 1.00 53.14 O HETATM 2328 O HOH A 805 -9.482 6.479 -13.320 1.00 34.62 O HETATM 2329 O HOH A 806 -19.349 -6.501 -0.850 1.00 46.08 O HETATM 2330 O HOH A 807 1.923 33.735 -16.559 1.00 35.78 O HETATM 2331 O HOH A 808 -10.372 15.891 -35.848 1.00 34.24 O HETATM 2332 O HOH A 809 -13.973 23.384 -22.677 1.00 27.54 O HETATM 2333 O HOH A 810 -12.370 -14.896 -9.884 1.00 41.70 O HETATM 2334 O HOH A 811 -17.521 20.901 -13.504 1.00 44.02 O HETATM 2335 O HOH A 812 7.998 11.594 -18.631 1.00 33.41 O HETATM 2336 O HOH A 813 -4.032 31.518 -20.840 1.00 31.12 O HETATM 2337 O HOH A 814 4.345 11.797 -16.880 1.00 21.52 O HETATM 2338 O HOH A 815 -15.275 -19.701 -15.263 1.00 39.75 O HETATM 2339 O HOH A 816 12.155 11.749 -30.543 1.00 35.30 O HETATM 2340 O HOH A 817 0.936 -9.488 -17.911 1.00 31.33 O HETATM 2341 O HOH A 818 -17.749 22.759 -22.785 1.00 43.96 O HETATM 2342 O HOH A 819 -2.471 1.833 -35.986 1.00 45.49 O HETATM 2343 O HOH A 820 -2.406 -3.580 -30.940 1.00 46.08 O HETATM 2344 O HOH A 821 -23.345 30.442 -20.302 1.00 49.05 O HETATM 2345 O HOH A 822 -5.892 20.672 -37.962 1.00 38.28 O HETATM 2346 O HOH A 823 -12.356 15.135 -9.856 1.00 43.24 O HETATM 2347 O HOH A 824 14.729 17.014 -34.957 1.00 58.83 O HETATM 2348 O HOH A 825 -12.427 12.201 -7.809 1.00 40.72 O HETATM 2349 O HOH A 826 3.077 24.721 -16.558 1.00 25.24 O HETATM 2350 O HOH A 827 -11.967 23.000 -26.832 1.00 33.51 O HETATM 2351 O HOH A 828 -1.990 -11.153 -17.795 1.00 25.66 O HETATM 2352 O HOH A 829 -19.982 18.513 -27.756 1.00 63.79 O HETATM 2353 O HOH A 830 -14.675 11.463 -31.310 1.00 38.16 O HETATM 2354 O HOH A 831 1.504 29.447 -30.066 1.00 49.25 O HETATM 2355 O HOH A 832 -3.805 37.136 -27.041 1.00 39.02 O HETATM 2356 O HOH A 833 -18.462 -22.829 -24.782 1.00 32.10 O HETATM 2357 O HOH A 834 -12.214 21.426 -30.866 1.00 41.57 O HETATM 2358 O HOH A 835 6.614 32.084 -10.508 1.00 45.79 O HETATM 2359 O HOH A 836 -13.851 17.431 -29.812 1.00 41.45 O HETATM 2360 O HOH A 837 -17.667 12.545 -10.660 1.00 49.38 O HETATM 2361 O HOH A 838 -12.173 10.528 -31.359 1.00 29.16 O HETATM 2362 O HOH A 839 -17.357 19.863 -8.621 1.00 57.22 O HETATM 2363 O HOH A 840 5.863 -4.005 -33.400 1.00 38.79 O HETATM 2364 O HOH A 841 -9.729 8.979 -6.506 1.00 63.15 O HETATM 2365 O HOH A 842 -11.197 17.696 -22.466 1.00 23.24 O HETATM 2366 O HOH A 843 14.566 12.066 -27.716 1.00 33.48 O HETATM 2367 O HOH A 844 -6.965 -3.249 -21.992 1.00 46.74 O HETATM 2368 O HOH A 845 -3.046 5.668 -14.366 1.00 37.19 O HETATM 2369 O HOH A 846 -2.275 35.331 -18.171 1.00 44.83 O HETATM 2370 O HOH A 847 6.852 -4.846 -25.441 1.00 42.03 O HETATM 2371 O HOH A 848 4.802 27.590 -27.837 1.00 28.68 O HETATM 2372 O HOH A 849 9.011 35.786 -15.960 1.00 46.41 O HETATM 2373 O HOH A 850 5.148 0.592 -18.484 1.00 23.63 O HETATM 2374 O HOH A 851 0.394 -0.664 -35.843 1.00 40.60 O HETATM 2375 O HOH A 852 -25.278 22.897 -22.864 1.00 32.90 O HETATM 2376 O HOH A 853 16.845 18.834 -31.010 1.00 37.31 O HETATM 2377 O HOH A 854 -5.489 12.233 -11.188 1.00 37.69 O HETATM 2378 O HOH A 855 -15.147 15.663 -8.460 1.00 41.59 O HETATM 2379 O HOH A 856 -3.594 22.364 -18.275 1.00 25.98 O HETATM 2380 O HOH A 857 11.957 19.789 -9.576 1.00 62.86 O HETATM 2381 O HOH A 858 -23.148 30.913 -16.086 1.00 44.21 O HETATM 2382 O HOH A 859 -4.389 -0.358 -0.300 1.00 57.25 O HETATM 2383 O HOH A 860 3.841 23.427 -18.860 1.00 20.36 O HETATM 2384 O HOH A 861 -2.833 6.361 -34.769 1.00 37.17 O HETATM 2385 O HOH A 862 -9.468 27.276 -19.277 1.00 37.30 O HETATM 2386 O HOH A 863 -15.243 20.402 -23.617 1.00 40.08 O HETATM 2387 O HOH A 864 5.685 -3.196 -19.700 1.00 36.67 O HETATM 2388 O HOH A 865 -7.698 13.210 -13.673 1.00 22.49 O HETATM 2389 O HOH A 866 3.614 26.049 -34.152 1.00 39.93 O HETATM 2390 O HOH A 867 4.759 -5.098 -13.379 1.00 52.11 O HETATM 2391 O HOH A 868 -16.513 6.742 -28.707 1.00 38.15 O HETATM 2392 O HOH A 869 -25.163 -2.261 -9.875 1.00 55.49 O HETATM 2393 O HOH A 870 -9.503 24.705 -32.497 1.00 44.23 O HETATM 2394 O HOH A 871 -4.287 -9.707 -21.308 1.00 32.97 O HETATM 2395 O HOH A 872 3.603 29.124 -10.143 1.00 49.32 O HETATM 2396 O HOH A 873 9.476 35.911 -25.508 1.00 52.76 O HETATM 2397 O HOH A 874 -21.368 13.845 -21.509 1.00 39.17 O HETATM 2398 O HOH A 875 -3.028 37.585 -16.868 1.00 35.51 O HETATM 2399 O HOH A 876 -4.650 18.075 -18.000 1.00 22.45 O HETATM 2400 O HOH A 877 -3.183 -5.155 -22.363 1.00 34.59 O HETATM 2401 O HOH A 878 -5.980 9.206 -8.346 1.00 60.65 O HETATM 2402 O HOH A 879 -0.400 5.516 -13.917 1.00 44.79 O HETATM 2403 O HOH A 880 -8.795 -12.227 -3.808 1.00 54.64 O HETATM 2404 O HOH A 881 -20.342 7.977 -25.482 1.00 41.02 O HETATM 2405 O HOH A 882 -8.144 4.952 -15.051 1.00 48.29 O HETATM 2406 O HOH A 883 -12.457 7.642 -31.141 1.00 41.48 O HETATM 2407 O HOH A 884 14.339 14.957 -17.918 1.00 56.61 O HETATM 2408 O HOH A 885 -19.470 -8.415 -2.679 1.00 55.19 O HETATM 2409 O HOH A 886 7.430 24.313 -22.810 1.00 25.21 O HETATM 2410 O HOH A 887 -5.592 3.243 -33.635 1.00 41.11 O HETATM 2411 O HOH A 888 3.272 31.544 -16.954 1.00 37.65 O HETATM 2412 O HOH A 889 -7.523 13.951 -0.297 1.00 50.01 O HETATM 2413 O HOH A 890 -16.162 2.493 -27.809 1.00 46.24 O HETATM 2414 O HOH A 891 -14.184 4.445 -19.951 1.00 37.62 O HETATM 2415 O HOH A 892 -18.524 -0.314 -26.192 1.00 55.58 O HETATM 2416 O HOH A 893 14.359 15.972 -24.664 1.00 31.71 O HETATM 2417 O HOH A 894 -0.344 17.389 -40.648 1.00 39.71 O HETATM 2418 O HOH A 895 -16.040 2.683 -18.325 1.00 30.56 O HETATM 2419 O HOH A 896 -19.704 12.631 -26.790 1.00 40.31 O HETATM 2420 O HOH A 897 -15.891 14.665 -10.996 1.00 39.66 O HETATM 2421 O HOH A 898 16.178 0.645 -23.961 1.00 43.59 O HETATM 2422 O HOH A 899 -17.617 16.491 -12.072 1.00 30.59 O HETATM 2423 O HOH A 900 -16.994 25.757 -12.337 1.00 34.76 O HETATM 2424 O HOH A 901 -10.044 -0.579 -21.289 1.00 31.15 O HETATM 2425 O HOH A 902 5.360 11.769 -14.375 1.00 26.91 O HETATM 2426 O HOH A 903 13.420 18.556 -19.287 1.00 30.55 O HETATM 2427 O HOH A 904 3.178 26.968 -15.087 1.00 46.69 O HETATM 2428 O HOH A 905 -8.584 20.946 -18.039 1.00 29.93 O HETATM 2429 O HOH A 906 -11.706 29.148 -26.717 1.00 52.25 O HETATM 2430 O HOH A 907 -18.344 23.735 -15.243 1.00 27.85 O HETATM 2431 O HOH A 908 -14.114 3.864 -22.595 1.00 29.17 O HETATM 2432 O HOH A 909 -21.404 19.244 -13.837 1.00 32.60 O HETATM 2433 O HOH A 910 -12.706 -14.331 -4.047 1.00 49.55 O HETATM 2434 O HOH A 911 8.869 0.784 -32.888 1.00 31.37 O HETATM 2435 O HOH A 912 -3.287 -1.481 -32.636 1.00 54.26 O HETATM 2436 O HOH A 913 -18.357 11.260 -4.716 1.00 47.45 O HETATM 2437 O HOH A 914 -10.588 22.160 -32.776 1.00 33.20 O HETATM 2438 O HOH A 915 -11.370 -10.278 1.911 1.00 61.89 O HETATM 2439 O HOH A 916 4.868 5.937 -14.347 1.00 34.72 O HETATM 2440 O HOH A 917 8.646 10.743 -16.385 1.00 44.58 O HETATM 2441 O HOH A 918 13.079 6.266 -34.848 1.00 37.93 O HETATM 2442 O HOH A 919 -10.179 34.527 -17.360 1.00 49.59 O HETATM 2443 O HOH A 920 -15.630 12.254 -33.947 1.00 58.44 O HETATM 2444 O HOH A 921 11.942 9.338 -32.077 1.00 43.15 O HETATM 2445 O HOH A 922 4.708 -2.808 -11.951 1.00 51.37 O HETATM 2446 O HOH A 923 -20.624 10.850 -22.217 1.00 56.42 O HETATM 2447 O HOH A 924 13.004 17.458 -12.559 1.00 57.95 O HETATM 2448 O HOH A 925 -26.935 30.309 -15.172 1.00 44.32 O HETATM 2449 O HOH A 926 12.284 16.761 -39.190 1.00 43.76 O HETATM 2450 O HOH A 927 -12.119 24.374 -24.566 1.00 24.67 O HETATM 2451 O HOH A 928 7.658 3.544 -49.316 1.00 48.24 O HETATM 2452 O HOH A 929 13.562 -0.992 -27.494 1.00 43.60 O HETATM 2453 O HOH A 930 0.082 -6.690 -15.570 1.00 49.06 O HETATM 2454 O HOH A 931 14.413 19.258 -24.969 1.00 42.46 O HETATM 2455 O HOH A 932 -9.959 -18.053 -6.922 1.00 65.71 O HETATM 2456 O HOH A 933 16.089 7.051 -27.032 1.00 53.09 O HETATM 2457 O HOH A 934 -14.593 -16.698 -8.703 1.00 51.32 O HETATM 2458 O HOH A 935 -10.608 16.035 -7.661 1.00 57.70 O HETATM 2459 O HOH A 936 16.853 16.795 -33.461 1.00 43.03 O HETATM 2460 O HOH A 937 4.169 2.110 -35.977 1.00 44.03 O HETATM 2461 O HOH A 938 -12.315 27.918 -22.667 1.00 52.30 O HETATM 2462 O HOH A 939 -10.534 20.593 -36.955 1.00 51.52 O HETATM 2463 O HOH A 940 5.775 9.419 -13.087 1.00 48.38 O HETATM 2464 O HOH A 941 15.692 13.974 -25.874 1.00 41.31 O HETATM 2465 O HOH A 942 16.736 18.503 -26.051 1.00 64.91 O HETATM 2466 O HOH A 943 -13.243 14.732 -1.815 1.00 62.68 O HETATM 2467 O HOH A 944 -5.730 20.849 -17.209 1.00 29.76 O HETATM 2468 O HOH A 945 -6.173 4.240 -13.053 1.00 48.71 O HETATM 2469 O HOH A 946 -4.203 33.253 -18.813 1.00 41.47 O HETATM 2470 O HOH A 947 -3.732 3.991 -35.163 1.00 42.14 O HETATM 2471 O HOH A 948 15.456 15.108 -21.621 1.00 60.89 O HETATM 2472 O HOH A 949 -2.455 37.263 -14.516 1.00 42.38 O HETATM 2473 O HOH A 950 14.085 8.960 -33.713 1.00 50.56 O HETATM 2474 O HOH A 951 16.254 18.611 -21.052 1.00 43.12 O HETATM 2475 O HOH A 952 -9.061 32.646 -18.964 1.00 45.04 O HETATM 2476 O HOH A 953 -15.395 22.244 -26.275 1.00 54.66 O HETATM 2477 O HOH A 954 3.776 1.226 -47.153 1.00 65.40 O HETATM 2478 O HOH A 955 11.392 -1.536 -29.487 1.00 52.61 O HETATM 2479 O HOH A 956 13.505 14.442 -37.673 1.00 59.95 O HETATM 2480 O HOH A 957 16.294 9.019 -30.858 1.00 62.86 O HETATM 2481 O HOH A 958 -0.080 37.073 -13.238 1.00 53.60 O HETATM 2482 O HOH A 959 -16.598 4.254 -29.861 1.00 57.40 O HETATM 2483 O HOH A 960 -11.378 10.494 -33.948 1.00 45.44 O HETATM 2484 O HOH A 961 -12.556 23.832 -29.300 1.00 38.92 O HETATM 2485 O HOH A 962 -5.062 5.627 -37.571 1.00 53.71 O HETATM 2486 O HOH A 963 -11.974 22.294 -35.431 1.00 50.91 O HETATM 2487 O HOH A 964 16.404 9.540 -28.173 1.00 47.14 O HETATM 2488 O HOH A 965 -10.126 29.866 -19.442 1.00 38.09 O HETATM 2489 O HOH A 966 19.100 17.633 -30.111 1.00 51.76 O HETATM 2490 O HOH A 967 -14.848 21.219 -31.890 1.00 49.99 O HETATM 2491 O HOH A 968 7.668 13.022 -14.847 1.00 49.87 O HETATM 2492 O HOH A 969 -13.203 14.125 -6.032 1.00 47.39 O HETATM 2493 O HOH A 970 -19.112 13.069 -8.571 1.00 47.91 O HETATM 2494 O HOH A 971 -1.005 -2.828 -34.786 1.00 59.95 O HETATM 2495 O HOH A 972 -18.327 8.880 -29.483 1.00 52.33 O HETATM 2496 O HOH A 973 -8.777 21.752 -38.473 1.00 46.59 O HETATM 2497 O HOH A 974 -7.860 25.598 -34.560 1.00 52.80 O HETATM 2498 O HOH A 975 -17.683 15.189 -6.996 1.00 57.22 O HETATM 2499 O HOH B 401 4.534 19.452 -11.588 1.00 23.89 O HETATM 2500 O HOH B 402 6.490 20.549 -10.225 1.00 51.38 O HETATM 2501 O HOH B 403 -0.364 8.640 -12.017 1.00 70.54 O HETATM 2502 O HOH B 404 7.318 25.677 -7.099 1.00 54.05 O HETATM 2503 O HOH B 405 4.542 14.263 -6.716 1.00 59.97 O HETATM 2504 O HOH B 406 -5.186 11.954 -8.558 1.00 57.47 O HETATM 2505 O HOH B 407 2.402 25.465 -6.872 1.00 58.52 O HETATM 2506 O HOH B 408 3.923 11.220 -5.158 1.00 60.13 O CONECT 1292 1298 CONECT 1298 1292 1299 CONECT 1299 1298 1300 1302 CONECT 1300 1299 1301 1314 CONECT 1301 1300 CONECT 1302 1299 1303 CONECT 1303 1302 1304 1305 CONECT 1304 1303 1306 CONECT 1305 1303 1307 CONECT 1306 1304 1308 CONECT 1307 1305 1308 CONECT 1308 1306 1307 1309 CONECT 1309 1308 1310 CONECT 1310 1309 1311 1312 1313 CONECT 1311 1310 CONECT 1312 1310 CONECT 1313 1310 CONECT 1314 1300 1315 CONECT 1315 1314 1316 1318 CONECT 1316 1315 1317 1330 CONECT 1317 1316 CONECT 1318 1315 1319 CONECT 1319 1318 1320 1321 CONECT 1320 1319 1322 CONECT 1321 1319 1323 CONECT 1322 1320 1324 CONECT 1323 1321 1324 CONECT 1324 1322 1323 1325 CONECT 1325 1324 1326 CONECT 1326 1325 1327 1328 1329 CONECT 1327 1326 CONECT 1328 1326 CONECT 1329 1326 CONECT 1330 1316 CONECT 2250 2255 CONECT 2255 2250 2256 CONECT 2256 2255 2257 2259 CONECT 2257 2256 2258 2271 CONECT 2258 2257 CONECT 2259 2256 2260 CONECT 2260 2259 2261 2262 CONECT 2261 2260 2263 CONECT 2262 2260 2264 CONECT 2263 2261 2265 CONECT 2264 2262 2265 CONECT 2265 2263 2264 2266 CONECT 2266 2265 2267 CONECT 2267 2266 2268 2269 2270 CONECT 2268 2267 CONECT 2269 2267 CONECT 2270 2267 CONECT 2271 2257 CONECT 2295 2313 2314 CONECT 2296 2313 2318 CONECT 2297 2310 2319 2321 CONECT 2298 2309 2310 CONECT 2299 2300 2305 CONECT 2300 2299 2301 2322 CONECT 2301 2300 2306 2323 CONECT 2302 2303 2310 CONECT 2303 2302 2304 CONECT 2304 2303 2309 CONECT 2305 2299 2311 CONECT 2306 2301 2311 CONECT 2307 2308 2317 CONECT 2308 2307 2318 CONECT 2309 2298 2304 2313 CONECT 2310 2297 2298 2302 CONECT 2311 2305 2306 2320 CONECT 2312 2314 2317 2318 CONECT 2313 2295 2296 2309 CONECT 2314 2295 2312 2320 CONECT 2315 2322 CONECT 2316 2323 CONECT 2317 2307 2312 CONECT 2318 2296 2308 2312 CONECT 2319 2297 CONECT 2320 2311 2314 CONECT 2321 2297 CONECT 2322 2300 2315 CONECT 2323 2301 2316 END